A0A077Z8N9_TRITR Loading...

Mitogen activated protein kinase kinase kinase

AlphaFold DB , UniProt , Accession A0A077Z8N9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,342 aa.

						>A0A077Z8N9_TRITR|A0A077Z8N9
MAAATGRKLTPAGGSAINVEASSANSEKFSRPLEIAVVIDLLVKDGLSLRQSVWNEIEKLAETMFVSAKLIQFEKLDFGETCSLDLFYNADVAVVDLSVSCQRTSLFYHLGVRESMDQKYNVVLYTMEEVREPSISLLLKFPFINYKTLLYALKDGHLVAFDCNQVVPNIVGTLQSGMSVSPQTGCTFCSKMKKFLKEVQIEASAHSREKFLCDLRQARQEPQSSKLKEILAKLRSRLDDPDVLSVDTVVNMLLSYSATLFSSHLTNLPLISLRDIQDYAAMVSLVEDIRSIPNNKIYESPAIQFNYAFALNRRNIDDDRARALELILDILKSQDNEVPDFLCLAGRIYKDRFSDSRFLDIEARDQAIYWYRKGFETQPNEYAGINLATLLVIAGHSFQTSSELQQIAVILSGLLGRKGSLSNMQDYWDVATFFEISVLAENYFNACQAAQRMFILKPPAWFALSRNYVQYICQRANNVAAMFRTVTERLFRFLKSTIGNIGLIEKFRRSLQQYSRENQMEYRRFLFWMDYFVESTKADDLHCDLRFPVLSMEPSKAYTPSYVSVNKDDKTIFLWHVTYSLPKSNFSQWIFPAESIRAVSAAKRDDRAVYLYVYLNSDDFMLFFPTDSHRHRFLDLVDEITSNVDGTKLLGDYSESQTIDFEFELDASGQRVVLGKGTFGAVYAGRDRTSQRTIAIKEVQIKNHEEVQPLMEEIQLHSTLAHTNIVQYLGCEVSDDNQVFRIFMEQVPGGSLSLLLRNKWGPLIDSENTMAYYAKQILEGLAYLHSQKIVHRDIKGDNVLVNTYSGLCKIVDFGTCKRLAGLNPVTDTFTGTLQYMAPEVIDHGQRGYGAPADVWSFGCTMIEMATGKPPFVELGSPQAAIFKVGMFKVHPPIPEKLSSCAKSFISRCFAANPKQRPSAAVLLNDYFFDQTHVKRKSKVDINFRENYRPPVRSASYISASSTNAQKEQPVSASSSVQSLNELTEIATPSEKSTANSGQDGQLSTRFFMMRKDYERRDTLSSIMLEFEDELVDLWVTSLKSDVQDYQCSISKEVFKSLLGAMRSYVIEKDKSSARNFVLHLKEHLDNDESALSQVCFALFVFQDVMHYVLRQQKIKPHWMFSLDNLTQSCSKCFIELLSPAVQNANGEPQENGGDSSSYASTEHAKSPSVPIFSYEVFHSVGLLGSQVKRDMKEVKEENQRLLEEVKSLCQICEDVRSKLAPKCRSLFLRRRSSSGVPSPHDCPNVTADSSSPEHTDTLVKWLRELNIDEETIDILKFENYSLEDLLCCVKSRRELVRVGIRAGVSCRLWKHIKEKRKQNGDNGLEEPLATTGSSCSEAGSDP
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.8	Very low	25.5	Very low	239 Å²	239	144.9 Å²	144.9	100%	1.177	87%	0.865	S	S	*	*				0	-12.9	0	-76	-156.1	-164.6	0	0	114.8	A3	M1-A3 PolarHBondContact O-N 2.98Å
2	A	26.5	Very low	25.2	Very low	107 Å²	107	141.9 Å²	141.9	88%	0.884	87%	0.868	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	3.7	-176.2	0	0	0	0	0	116.3
3	A	27.9	Very low	25.2	Very low	108 Å²	108	137.5 Å²	137.5	89%	0.893	87%	0.869	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	0.4	-177.1	0	0	0	0	0	114.7	M1	M1-A3 PolarHBondContact O-N 2.98Å
4	A	28.1	Very low	25.1	Very low	88 Å²	88	132 Å²	132	73%	0.727	85%	0.851	S	S	*	*	S	Bend	trans	-115.2	5.2	-163.9	0	0	0	0	0	116.9
5	T	28	Very low	25.1	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	84%	0.843	S	S	*	*			trans	-132.9	81.6	-179.7	57.5	0	0	0	0	112	R7	T5-R7 PolarHBondContact O-N 3.47Å
6	G	23.2	Very low	24.9	Very low	91 Å²	91	127.7 Å²	127.7	94%	0.938	84%	0.837	S	S	*	*			trans	-69.5	62	170.5	0	0	0	0	0	113.6
7	R	22.8	Very low	25	Very low	218 Å²	218	128.5 Å²	128.5	82%	0.823	83%	0.831	S	S	*	*			trans	-106.2	110	166.9	-80.9	-173.4	177.3	177.5	-0.2	109.4	T5 L9	T5-R7 PolarHBondContact O-N 3.47Å; R7-L9 PolarHBondContact O-N 2.92Å
8	K	24.4	Very low	24.8	Very low	209 Å²	209	128.7 Å²	128.7	91%	0.909	82%	0.824	S	S	*	*			trans	-56.9	105.7	165.4	-75.2	-179	174.9	-178.6	0	108	T10	K8-T10 PolarHBondContact O-N 3.04Å
9	L	23.8	Very low	24.9	Very low	167 Å²	167	128.7 Å²	128.7	87%	0.874	82%	0.822	S	S	*	*			trans	-81	105.6	173.4	-79.2	156.3	0	0	0	108.1	R7	R7-L9 PolarHBondContact O-N 2.92Å
10	T	23.7	Very low	24.8	Very low	126 Å²	126	131.4 Å²	131.4	77%	0.773	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.9	125.6	168.7	46.7	0	0	0	0	109.4	K8 A12	K8-T10 PolarHBondContact O-N 3.04Å; T10-A12 PolarHBondContact O-N 3.37Å
11	P	26.1	Very low	24.8	Very low	121 Å²	121	129.6 Å²	129.6	79%	0.786	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-65.7	129.8	179.7	-16.7	29.1	0	0	0	111.8
12	A	22.7	Very low	24.8	Very low	109 Å²	109	123.2 Å²	123.2	90%	0.901	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	129	171.7	0	0	0	0	0	110.1	T10	T10-A12 PolarHBondContact O-N 3.37Å
13	G	24.3	Very low	24.7	Very low	85 Å²	85	123.9 Å²	123.9	88%	0.876	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.1	-15.1	165.7	0	0	0	0	0	116.5
14	G	24.3	Very low	24.7	Very low	60 Å²	60	123 Å²	123	62%	0.619	79%	0.79	S	S	*	*	S	Bend	trans	-91.6	119.8	162.8	0	0	0	0	0	108.3	A16	G14-A16 PolarHBondContact O-N 2.79Å
15	S	24.5	Very low	24.7	Very low	105 Å²	105	125.4 Å²	125.4	73%	0.734	79%	0.791	S	S	*	*			trans	-42.1	117.8	164.4	48.6	0	0	0	0	108.3	I17	S15-I17 VanDerWaalsContact C-N 3.26Å; S15-I17 PolarHBondContact O-N 3Å
16	A	23	Very low	24.6	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	80%	0.796	S	S	*	*			trans	-58.9	95.6	173.8	0	0	0	0	0	107.3	G14 N18	G14-A16 PolarHBondContact O-N 2.79Å; A16-N18 PolarHBondContact O-N 3.43Å
17	I	25.4	Very low	25.2	Very low	142 Å²	142	127.7 Å²	127.7	73%	0.728	78%	0.782	S	S	*	*			trans	-65.1	100	164.5	-61.5	175.5	0	0	0	103.4	S15 V19	S15-I17 VanDerWaalsContact C-N 3.26Å; S15-I17 PolarHBondContact O-N 3Å; I17-V19 WeakPolarHBondContact O-CG2 3.36Å; I17-V19 PolarHBondContact O-N 2.64Å
18	N	21.6	Very low	25.8	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	79%	0.787	S	S	*	*			trans	-52.1	104.9	170.6	-91.5	-29.7	0	0	0	107.8	A16 E20	A16-N18 PolarHBondContact O-N 3.43Å; N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact O-N 3.1Å
19	V	26.3	Very low	26.9	Very low	129 Å²	129	122.2 Å²	122.2	78%	0.782	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	5.7	177.3	-178.6	0	0	0	0	111.7	I17 A21	I17-V19 WeakPolarHBondContact O-CG2 3.36Å; I17-V19 PolarHBondContact O-N 2.64Å; V19-A21 VanDerWaalsContact C-N 3.33Å; V19-A21 PolarHBondContact O-N 3.35Å
20	E	23.5	Very low	28.2	Very low	182 Å²	182	119 Å²	119	85%	0.85	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	2.2	177.6	-69.5	-169.2	163.1	0	0	114.7	N18	N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact O-N 3.1Å
21	A	24.3	Very low	29.9	Very low	93 Å²	93	119.1 Å²	119.1	77%	0.769	74%	0.742	S	S	*	*	S	Bend	trans	-118.1	53.7	-178.7	0	0	0	0	0	113.7	V19	V19-A21 VanDerWaalsContact C-N 3.33Å; V19-A21 PolarHBondContact O-N 3.35Å
22	S	26.1	Very low	31.9	Very low	105 Å²	105	116.9 Å²	116.9	73%	0.734	73%	0.728	S	S	*	*			trans	-152	49.3	162.3	67.9	0	0	0	0	112.2
23	S	25.7	Very low	34.7	Very low	122 Å²	122	112.3 Å²	112.3	85%	0.853	69%	0.688	S	S	*	*			trans	-95.1	22.2	174.6	57.3	0	0	0	0	113.7
24	A	26.6	Very low	37.6	Very low	88 Å²	88	111.6 Å²	111.6	73%	0.727	66%	0.662	S	S	*	*			trans	-124.5	3.6	-170.1	0	0	0	0	0	116.6
25	N	27.7	Very low	40.7	Very low	139 Å²	139	109 Å²	109	74%	0.743	63%	0.634	S	S	*	*			trans	-102	105	171.8	-77.2	-9.8	0	0	0	109.7	E27	N25-E27 HydrophobicContact CB-CG 4.22Å; N25-E27 PolarHBondContact O-N 2.94Å
26	S	27.3	Very low	44	Very low	122 Å²	122	104.1 Å²	104.1	85%	0.853	60%	0.6	S	S	*	*			trans	-66.3	78.5	164.3	58.1	0	0	0	0	108.8	K28	S26-K28 PolarHBondContact O-N 3.16Å
27	E	35.9	Very low	47.4	Very low	138 Å²	138	99.9 Å²	99.9	65%	0.645	57%	0.565	S	S	*	*			trans	-68.7	121.4	175.8	-73.4	-177.2	168.4	0	0	109.2	N25 F29	N25-E27 HydrophobicContact CB-CG 4.22Å; N25-E27 PolarHBondContact O-N 2.94Å; E27-F29 VanDerWaalsContact O-CD2 3.3Å; E27-F29 WeakPolarHBondContact O-CD2 3.48Å; E27-F29 PolarHBondContact O-N 3.44Å
28	K	35.5	Very low	50.7	Low	210 Å²	210	93.1 Å²	93.1	91%	0.913	53%	0.53	S	S	*	.			trans	-68.3	98.5	171.1	-73.2	178.7	175.5	179.9	0	107.7	S26 S30	S26-K28 PolarHBondContact O-N 3.16Å; K28-S30 PolarHBondContact O-N 3.01Å
29	F	47.3	Very low	54	Low	101 Å²	101	87 Å²	87	44%	0.443	50%	0.498	S	S	.	.			trans	-58.4	131.9	173	-62.4	-84.5	0	0	0	110.4	E27 Q200	E27-F29 VanDerWaalsContact O-CD2 3.3Å; E27-F29 WeakPolarHBondContact O-CD2 3.48Å; E27-F29 PolarHBondContact O-N 3.44Å; F29-Q200 HydrophobicContact CD1-CG 4.18Å; F29-Q200 HydrophobicContact CD2-CG 4.32Å; F29-Q200 HydrophobicContact CE1-CG 4.13Å; F29-Q200 HydrophobicContact CE2-CG 4.26Å; F29-Q200 HydrophobicContact CG-CG 4.28Å; F29-Q200 HydrophobicContact CZ-CG 4.16Å
30	S	50.6	Low	57	Low	101 Å²	101	81.5 Å²	81.5	71%	0.706	46%	0.464	S	S	*	.	S	Bend	trans	-83.5	-26.1	-169	63.7	0	0	0	0	114.5	K28	K28-S30 PolarHBondContact O-N 3.01Å
31	R	58.8	Low	60.1	Low	127 Å²	127	75.2 Å²	75.2	48%	0.479	44%	0.436	S	S	.	.	S	Bend	trans	-108.1	126	173.6	76.8	-175	-172.8	106.7	2	110.5	D91	R31-D91 IonicContact CZ-OD1 3.45Å; R31-D91 VanDerWaalsContact CZ-OD1 3.26Å; R31-D91 IonicContact CZ-OD2 2.76Å; R31-D91 IonicContact NH1-OD1 3.56Å; R31-D91 PolarHBondContact NH1-OD1 3.36Å; R31-D91 IonicContact NH1-OD2 2.98Å; R31-D91 PolarHBondContact NH1-OD2 2.81Å; R31-D91 VanDerWaalsContact NH1-OD2 3.14Å; R31-D91 IonicContact NH2-OD1 3.68Å; R31-D91 PolarHBondContact NH2-OD1 3.35Å
32	P	68.7	Low	63.1	Low	75 Å²	75	76.3 Å²	76.3	49%	0.487	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-64.8	138.4	168.9	28.5	-32.6	0	0	0	108.6	E34 F65	P32-E34 PolarHBondContact O-N 3.17Å; P32-F65 WeakPolarHBondContact CB-O 3.48Å
33	L	81	Confident	65.9	Low	12 Å²	12	73.1 Å²	73.1	6%	0.063	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-55.7	139.7	171.3	-103	101.1	0	0	0	109.2	V66 S67 D91 V92 V199 Q200	L33-V66 HydrophobicContact CB-CG1 3.69Å; L33-V66 HydrophobicContact CB-CG2 4.19Å; L33-V66 WeakPolarHBondContact O-CG1 3.14Å; L33-S67 PolarHBondContact O-N 3.19Å; L33-D91 HydrophobicContact CD2-CB 4.12Å; L33-D91 HydrophobicContact CG-CB 4.31Å; L33-V92 HydrophobicContact CD2-CG2 3.82Å; L33-V199 HydrophobicContact CD2-CB 4.4Å; L33-V199 HydrophobicContact CD2-CG1 3.87Å; L33-Q200 HydrophobicContact CD1-CB 3.76Å; L33-Q200 HydrophobicContact CD1-CG 3.77Å
34	E	84.5	Confident	68.6	Low	71 Å²	71	75.9 Å²	75.9	33%	0.332	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.9	168.9	-69.5	-157.1	125.4	0	0	110.7	P32 S67 K69 A90 D91 V92	P32-E34 PolarHBondContact O-N 3.17Å; E34-S67 CarbonylContact C-O 3.49Å; E34-S67 WeakPolarHBondContact CA-O 3.32Å; E34-K69 IonicContact OE1-NZ 2.93Å; E34-K69 PolarHBondContact OE1-NZ 2.82Å; E34-A90 HydrophobicContact CB-CB 4.47Å; E34-D91 PolarHBondContact N-OD2 3.26Å; E34-D91 PolarHBondContact O-N 2.9Å; E34-V92 PolarHBondContact O-N 3.15Å; E34-V92 VanDerWaalsContact O-N 3.1Å
35	I	91.4	Very high	71.2	Confident	6 Å²	6	78.2 Å²	78.2	3%	0.031	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120	176.4	-52.2	177.9	0	0	0	109	V37 V66 S67 A68 K69 V92 V94 L196	I35-V37 HydrophobicContact CG2-CG2 3.8Å; I35-V66 HydrophobicContact CD1-CG1 3.42Å; I35-V66 VanDerWaalsContact CD1-CG1 3.42Å; I35-V66 HydrophobicContact CG1-CG1 3.58Å; I35-S67 PolarHBondContact N-O 3.44Å; I35-A68 HydrophobicContact CB-CB 4.35Å; I35-A68 WeakPolarHBondContact O-CA 3.25Å; I35-K69 PolarHBondContact O-N 3.29Å; I35-V92 CarbonylContact C-O 3.57Å; I35-V92 VanDerWaalsContact CA-O 3.3Å; I35-V92 WeakPolarHBondContact CA-O 3.25Å; I35-V92 HydrophobicContact CG1-CB 4.25Å; I35-V92 HydrophobicContact CG2-CB 4.39Å; I35-V92 HydrophobicContact CG2-CG1 4.36Å; I35-V94 HydrophobicContact CG2-CG2 3.78Å; I35-L196 HydrophobicContact CD1-CD1 3.66Å; I35-L196 HydrophobicContact CD1-CD2 3.59Å; I35-L196 HydrophobicContact CD1-CG 4.28Å; I35-L196 HydrophobicContact CG1-CD2 4.28Å
36	A	92.5	Very high	73.7	Confident	2 Å²	2	73 Å²	73	2%	0.017	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.3	167.4	0	0	0	0	0	109.5	I71 F87 A90 V92 A93 V94	A36-I71 HydrophobicContact CB-CD1 3.83Å; A36-F87 HydrophobicContact CB-CD2 4.12Å; A36-A90 HydrophobicContact CB-CB 3.56Å; A36-V92 PolarHBondContact N-O 3.08Å; A36-A93 CarbonylContact O-C 3.41Å; A36-A93 WeakPolarHBondContact O-CA 3.37Å; A36-V94 PolarHBondContact O-N 3.41Å
37	V	94.9	Very high	76.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.3	-178	-175.9	0	0	0	0	109.4	I35 I39 W54 I57 K69 L70 I71 V94	I35-V37 HydrophobicContact CG2-CG2 3.8Å; V37-I39 HydrophobicContact CG1-CD1 3.59Å; V37-I39 HydrophobicContact CG1-CG1 3.74Å; V37-W54 HydrophobicContact CB-CE3 4.29Å; V37-W54 HydrophobicContact CB-CZ3 3.93Å; V37-W54 HydrophobicContact CG1-CE3 3.96Å; V37-W54 HydrophobicContact CG1-CZ3 4.11Å; V37-W54 HydrophobicContact CG2-CZ3 4Å; V37-I57 HydrophobicContact CG1-CD1 4Å; V37-I57 HydrophobicContact CG2-CD1 4.47Å; V37-I57 HydrophobicContact CG2-CG2 3.99Å; V37-K69 PolarHBondContact N-O 3.18Å; V37-L70 HydrophobicContact CG1-CD1 4.26Å; V37-L70 CarbonylContact O-C 3.57Å; V37-L70 WeakPolarHBondContact O-CA 3.01Å; V37-I71 PolarHBondContact O-N 3.08Å; V37-V94 CarbonylContact C-O 3.59Å; V37-V94 WeakPolarHBondContact CA-O 3.36Å; V37-V94 HydrophobicContact CG1-CB 4.44Å; V37-V94 HydrophobicContact CG2-CB 4.29Å
38	V	94.1	Very high	78.8	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	97.6	177	-169.5	0	0	0	0	108.2	I71 F73 L76 F87 V94 V95 D96 L106	V38-I71 HydrophobicContact CG2-CB 4.24Å; V38-F73 HydrophobicContact CG1-CB 4.45Å; V38-L76 HydrophobicContact CG1-CD2 4.32Å; V38-L76 HydrophobicContact CG2-CD2 3.92Å; V38-F87 HydrophobicContact CG2-CD2 3.78Å; V38-F87 HydrophobicContact CG2-CE2 3.75Å; V38-V94 PolarHBondContact N-O 2.9Å; V38-V95 HydrophobicContact CB-CG1 4.46Å; V38-V95 HydrophobicContact CB-CG2 4.35Å; V38-V95 HydrophobicContact CG2-CG2 4.3Å; V38-D96 PolarHBondContact O-N 3.3Å; V38-L106 HydrophobicContact CB-CD2 4.43Å; V38-L106 HydrophobicContact CG1-CD2 3.77Å
39	I	91.4	Very high	81.3	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	31%	0.307	C	S	.	.			trans	-130.3	120.9	175.9	-59.9	171.5	0	0	0	106.9	V37 L41 R50 V53 W54 I57 L70 D96	V37-I39 HydrophobicContact CG1-CD1 3.59Å; V37-I39 HydrophobicContact CG1-CG1 3.74Å; I39-L41 HydrophobicContact CG2-CD2 3.97Å; I39-L41 PolarHBondContact O-N 3.33Å; I39-R50 HydrophobicContact CG2-CB 3.71Å; I39-R50 HydrophobicContact CG2-CG 4.03Å; I39-V53 HydrophobicContact CD1-CB 4.33Å; I39-V53 HydrophobicContact CD1-CG1 3.72Å; I39-W54 HydrophobicContact CD1-CB 4.29Å; I39-I57 HydrophobicContact CD1-CD1 4.16Å; I39-L70 HydrophobicContact CB-CD1 4.23Å; I39-D96 HydrophobicContact CB-CB 4.43Å; I39-D96 HydrophobicContact CG1-CB 3.98Å; I39-D96 HydrophobicContact CG2-CB 4.43Å
40	D	90	Very high	83.2	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.07	29%	0.287	C	S	.	.			trans	-78.9	107.4	179.3	-164.1	-29.8	0	0	0	111.3	L42 V43 R50 F73 Q102	D40-L42 WeakPolarHBondContact OD1-CA 3.5Å; D40-L42 VanDerWaalsContact OD1-CB 3.28Å; D40-L42 WeakPolarHBondContact OD1-CB 3.42Å; D40-L42 PolarHBondContact OD1-N 2.93Å; D40-V43 HydrophobicContact CB-CG2 4.34Å; D40-V43 PolarHBondContact OD1-N 3.5Å; D40-R50 WeakPolarHBondContact O-CD 3.38Å; D40-R50 PolarHBondContact O-NE 3.09Å; D40-F73 HydrophobicContact CB-CB 4.47Å; D40-Q102 PolarHBondContact OD2-NE2 3.28Å
41	L	88.7	Confident	85	Confident	50 Å²	50	52.1 Å²	52.1	26%	0.262	27%	0.272	S	S	.	.	S	Bend	trans	-89.1	3.1	176.8	-57	-177.3	0	0	0	113.5	I39 L47 R50 Q51 L70	I39-L41 HydrophobicContact CG2-CD2 3.97Å; I39-L41 PolarHBondContact O-N 3.33Å; L41-L47 HydrophobicContact CB-CD1 4.42Å; L41-L47 WeakPolarHBondContact O-CD1 3.3Å; L41-R50 HydrophobicContact CD2-CB 4.36Å; L41-Q51 HydrophobicContact CD2-CG 3.97Å; L41-L70 HydrophobicContact CD1-CD2 3.67Å; L41-L70 HydrophobicContact CG-CD2 4.41Å
42	L	86.1	Confident	86.4	Confident	116 Å²	116	47.9 Å²	47.9	61%	0.607	26%	0.262	S	S	*	.	S	Bend	trans	-97.3	-28.9	179.3	-57.3	178.3	0	0	0	112.4	D40 K44	D40-L42 WeakPolarHBondContact OD1-CA 3.5Å; D40-L42 VanDerWaalsContact OD1-CB 3.28Å; D40-L42 WeakPolarHBondContact OD1-CB 3.42Å; D40-L42 PolarHBondContact OD1-N 2.93Å; L42-K44 PolarHBondContact O-N 3.3Å
43	V	85.8	Confident	87.5	Confident	38 Å²	38	44.3 Å²	44.3	23%	0.23	24%	0.239	C	C	.	.			trans	-68	126.6	174.9	177.8	0	0	0	0	109.6	D40 R50 V99	D40-V43 HydrophobicContact CB-CG2 4.34Å; D40-V43 PolarHBondContact OD1-N 3.5Å; V43-R50 VanDerWaalsContact CB-NH2 3.32Å; V43-R50 PolarHBondContact O-NH2 3.39Å; V43-V99 HydrophobicContact CB-CG2 4.41Å; V43-V99 HydrophobicContact CG1-CG1 4.46Å; V43-V99 HydrophobicContact CG1-CG2 4.35Å; V43-V99 HydrophobicContact CG2-CG1 4.2Å; V43-V99 HydrophobicContact CG2-CG2 4.33Å
44	K	82.4	Confident	88	Confident	180 Å²	180	45.2 Å²	45.2	78%	0.783	24%	0.242	S	C	*	.			trans	-73.6	-35	-174.9	-66.8	-175.9	-179.7	178.7	0	113.4	L42 G46 L47	L42-K44 PolarHBondContact O-N 3.3Å; K44-G46 PolarHBondContact O-N 2.77Å; K44-L47 WeakPolarHBondContact O-CB 3.31Å; K44-L47 PolarHBondContact O-N 2.99Å
45	D	79.7	Confident	88.3	Confident	137 Å²	137	45.5 Å²	45.5	73%	0.733	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	115.3	-175.7	-62.1	-27.4	0	0	0	110.6	L47 R50	D45-L47 VanDerWaalsContact C-N 3.34Å; D45-R50 PolarHBondContact O-NH1 3.4Å; D45-R50 PolarHBondContact O-NH2 3.16Å
46	G	81.4	Confident	88.2	Confident	30 Å²	30	47.4 Å²	47.4	31%	0.309	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	12.7	-176.4	0	0	0	0	0	115.2	K44 S48 L49 R50	K44-G46 PolarHBondContact O-N 2.77Å; G46-S48 VanDerWaalsContact C-N 3.34Å; G46-S48 PolarHBondContact O-N 3.23Å; G46-L49 PolarHBondContact O-N 3.26Å; G46-R50 PolarHBondContact O-N 2.77Å
47	L	85.6	Confident	88.1	Confident	45 Å²	45	47.5 Å²	47.5	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-55.4	-42.3	-175	179.4	60.4	0	0	0	113.9	L41 K44 D45 L49 R50 Q51	L41-L47 HydrophobicContact CB-CD1 4.42Å; L41-L47 WeakPolarHBondContact O-CD1 3.3Å; K44-L47 WeakPolarHBondContact O-CB 3.31Å; K44-L47 PolarHBondContact O-N 2.99Å; D45-L47 VanDerWaalsContact C-N 3.34Å; L47-L49 VanDerWaalsContact C-N 3.29Å; L47-L49 PolarHBondContact O-N 3.19Å; L47-R50 PolarHBondContact O-N 2.86Å; L47-Q51 HydrophobicContact CD1-CG 3.98Å; L47-Q51 HydrophobicContact CG-CG 4.29Å; L47-Q51 WeakPolarHBondContact O-CB 3.45Å; L47-Q51 WeakPolarHBondContact O-CG 3.33Å; L47-Q51 PolarHBondContact O-N 3.16Å
48	S	84.1	Confident	87.8	Confident	74 Å²	74	51.5 Å²	51.5	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-61.6	-37	-178.6	56.5	0	0	0	0	112.8	G46 S52	G46-S48 VanDerWaalsContact C-N 3.34Å; G46-S48 PolarHBondContact O-N 3.23Å; S48-S52 PolarHBondContact O-N 3.08Å; S48-S52 PolarHBondContact O-OG 2.83Å
49	L	87.6	Confident	87.5	Confident	22 Å²	22	58 Å²	58	12%	0.115	30%	0.302	C	S	.	.	H	α-helix	trans	-70.9	-47.6	175.8	-102.4	113.5	0	0	0	111.3	G46 L47 Q51 S52 V53 T126 Y151 L153	G46-L49 PolarHBondContact O-N 3.26Å; L47-L49 VanDerWaalsContact C-N 3.29Å; L47-L49 PolarHBondContact O-N 3.19Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; L49-Q51 PolarHBondContact O-N 3.26Å; L49-S52 WeakPolarHBondContact O-CB 3.49Å; L49-S52 PolarHBondContact O-N 2.95Å; L49-S52 VanDerWaalsContact O-N 3.08Å; L49-V53 WeakPolarHBondContact O-CG2 3.38Å; L49-V53 PolarHBondContact O-N 3.17Å; L49-T126 HydrophobicContact CD2-CG2 3.9Å; L49-Y151 HydrophobicContact CB-CE2 4.17Å; L49-Y151 HydrophobicContact CD2-CD2 3.77Å; L49-Y151 HydrophobicContact CD2-CE2 3.94Å; L49-L153 HydrophobicContact CD1-CB 4.49Å; L49-L153 HydrophobicContact CD1-CD1 3.91Å; L49-L153 HydrophobicContact CG-CB 4.49Å; L49-L153 HydrophobicContact CG-CD1 3.78Å; L49-L153 HydrophobicContact CG-CG 4.2Å
50	R	89	Confident	87.4	Confident	5 Å²	5	58 Å²	58	2%	0.019	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-41.2	177.5	-75.3	-163.7	-66.1	-95.7	-8	112.6	I39 D40 L41 V43 D45 G46 L47 S52 V53 W54 D96	I39-R50 HydrophobicContact CG2-CB 3.71Å; I39-R50 HydrophobicContact CG2-CG 4.03Å; D40-R50 WeakPolarHBondContact O-CD 3.38Å; D40-R50 PolarHBondContact O-NE 3.09Å; L41-R50 HydrophobicContact CD2-CB 4.36Å; V43-R50 VanDerWaalsContact CB-NH2 3.32Å; V43-R50 PolarHBondContact O-NH2 3.39Å; D45-R50 PolarHBondContact O-NH1 3.4Å; D45-R50 PolarHBondContact O-NH2 3.16Å; G46-R50 PolarHBondContact O-N 2.77Å; L47-R50 PolarHBondContact O-N 2.86Å; R50-S52 VanDerWaalsContact C-N 3.33Å; R50-S52 PolarHBondContact O-N 2.95Å; R50-V53 PolarHBondContact O-N 3.45Å; R50-W54 PolarHBondContact O-N 3.35Å; R50-W54 VanDerWaalsContact O-N 3.11Å; R50-D96 WeakPolarHBondContact CD-OD2 3.38Å
51	Q	88.1	Confident	87.1	Confident	86 Å²	86	57.8 Å²	57.8	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-61.6	-40.6	173.2	-76.2	177.4	-13.8	0	0	112.1	L41 L47 L49 V53 W54 N55	L41-Q51 HydrophobicContact CD2-CG 3.97Å; L47-Q51 HydrophobicContact CD1-CG 3.98Å; L47-Q51 HydrophobicContact CG-CG 4.29Å; L47-Q51 WeakPolarHBondContact O-CB 3.45Å; L47-Q51 WeakPolarHBondContact O-CG 3.33Å; L47-Q51 PolarHBondContact O-N 3.16Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; L49-Q51 PolarHBondContact O-N 3.26Å; Q51-V53 VanDerWaalsContact C-N 3.33Å; Q51-V53 PolarHBondContact O-N 3.19Å; Q51-W54 PolarHBondContact O-N 3.32Å; Q51-N55 WeakPolarHBondContact O-CB 3.3Å; Q51-N55 PolarHBondContact O-N 3.44Å; Q51-N55 PolarHBondContact O-ND2 3.06Å; Q51-N55 PolarHBondContact O-OD1 3.08Å
52	S	88.3	Confident	86.8	Confident	38 Å²	38	62.1 Å²	62.1	27%	0.266	32%	0.32	S	S	.	.	H	α-helix	trans	-64.1	-37.8	177.4	-59.7	0	0	0	0	112.3	S48 L49 R50 E56	S48-S52 PolarHBondContact O-N 3.08Å; S48-S52 PolarHBondContact O-OG 2.83Å; L49-S52 WeakPolarHBondContact O-CB 3.49Å; L49-S52 PolarHBondContact O-N 2.95Å; L49-S52 VanDerWaalsContact O-N 3.08Å; R50-S52 VanDerWaalsContact C-N 3.33Å; R50-S52 PolarHBondContact O-N 2.95Å; S52-E56 PolarHBondContact O-N 3.29Å; S52-E56 VanDerWaalsContact O-N 3.16Å
53	V	90.8	Very high	86.7	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-50.5	175.2	173.9	0	0	0	0	111.2	I39 L49 R50 Q51 N55 E56 I57 L124 Y151 L158 F188	I39-V53 HydrophobicContact CD1-CB 4.33Å; I39-V53 HydrophobicContact CD1-CG1 3.72Å; L49-V53 WeakPolarHBondContact O-CG2 3.38Å; L49-V53 PolarHBondContact O-N 3.17Å; R50-V53 PolarHBondContact O-N 3.45Å; Q51-V53 VanDerWaalsContact C-N 3.33Å; Q51-V53 PolarHBondContact O-N 3.19Å; V53-N55 VanDerWaalsContact C-N 3.33Å; V53-N55 PolarHBondContact O-N 3.19Å; V53-E56 PolarHBondContact O-N 3.34Å; V53-I57 HydrophobicContact CG1-CD1 3.98Å; V53-I57 WeakPolarHBondContact O-CG1 3.24Å; V53-I57 PolarHBondContact O-N 2.95Å; V53-L124 HydrophobicContact CG1-CD1 3.66Å; V53-Y151 HydrophobicContact CG2-CD1 4.37Å; V53-Y151 HydrophobicContact CG2-CD2 3.45Å; V53-Y151 VanDerWaalsContact CG2-CD2 3.45Å; V53-Y151 HydrophobicContact CG2-CE1 4.46Å; V53-Y151 HydrophobicContact CG2-CE2 3.57Å; V53-Y151 HydrophobicContact CG2-CG 3.88Å; V53-L158 HydrophobicContact CB-CD2 4.24Å; V53-L158 HydrophobicContact CG2-CD1 3.99Å; V53-L158 HydrophobicContact CG2-CD2 3.76Å; V53-F188 HydrophobicContact CG1-CE1 4.39Å; V53-F188 HydrophobicContact CG1-CE2 4.04Å; V53-F188 HydrophobicContact CG1-CZ 3.8Å
54	W	92.4	Very high	86.5	Confident	30 Å²	30	60.5 Å²	60.5	11%	0.114	31%	0.314	C	S	.	.	H	α-helix	trans	-57	-47.8	178	170.1	-110.5	0	0	0	111.5	V37 I39 R50 Q51 E56 I57 E58 L70	V37-W54 HydrophobicContact CB-CE3 4.29Å; V37-W54 HydrophobicContact CB-CZ3 3.93Å; V37-W54 HydrophobicContact CG1-CE3 3.96Å; V37-W54 HydrophobicContact CG1-CZ3 4.11Å; V37-W54 HydrophobicContact CG2-CZ3 4Å; I39-W54 HydrophobicContact CD1-CB 4.29Å; R50-W54 PolarHBondContact O-N 3.35Å; R50-W54 VanDerWaalsContact O-N 3.11Å; Q51-W54 PolarHBondContact O-N 3.32Å; W54-E56 VanDerWaalsContact C-N 3.26Å; W54-E56 PolarHBondContact O-N 3.39Å; W54-I57 PolarHBondContact O-N 3.43Å; W54-I57 VanDerWaalsContact O-N 3.07Å; W54-E58 HydrophobicContact CZ2-CB 4.23Å; W54-E58 HydrophobicContact CZ2-CG 4.3Å; W54-E58 WeakPolarHBondContact O-CB 3.48Å; W54-E58 PolarHBondContact O-N 3.49Å; W54-L70 HydrophobicContact CD2-CB 4.38Å; W54-L70 HydrophobicContact CD2-CD1 4.25Å; W54-L70 HydrophobicContact CD2-CD2 4.25Å; W54-L70 HydrophobicContact CE3-CB 4.15Å; W54-L70 HydrophobicContact CE3-CD1 3.95Å; W54-L70 HydrophobicContact CE3-CG 4.48Å; W54-L70 HydrophobicContact CH2-CB 3.67Å; W54-L70 HydrophobicContact CZ2-CB 3.9Å; W54-L70 HydrophobicContact CZ3-CB 3.8Å; W54-L70 HydrophobicContact CZ3-CD1 4.32Å
55	N	90	Very high	86.3	Confident	78 Å²	78	60.6 Å²	60.6	42%	0.417	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-32.8	179.4	-67.3	-16.7	0	0	0	113.1	Q51 V53 K59	Q51-N55 WeakPolarHBondContact O-CB 3.3Å; Q51-N55 PolarHBondContact O-N 3.44Å; Q51-N55 PolarHBondContact O-ND2 3.06Å; Q51-N55 PolarHBondContact O-OD1 3.08Å; V53-N55 VanDerWaalsContact C-N 3.33Å; V53-N55 PolarHBondContact O-N 3.19Å; N55-K59 VanDerWaalsContact O-CG 3.3Å; N55-K59 WeakPolarHBondContact O-CG 3.29Å; N55-K59 PolarHBondContact O-N 2.73Å
56	E	89.5	Confident	86.6	Confident	45 Å²	45	54.7 Å²	54.7	21%	0.21	28%	0.283	C	S	.	.	H	α-helix	trans	-75	-36.3	174	-78.7	-153.9	-174	0	0	113.1	S52 V53 W54 L60 L158 F188 C189	S52-E56 PolarHBondContact O-N 3.29Å; S52-E56 VanDerWaalsContact O-N 3.16Å; V53-E56 PolarHBondContact O-N 3.34Å; W54-E56 VanDerWaalsContact C-N 3.26Å; W54-E56 PolarHBondContact O-N 3.39Å; E56-L60 VanDerWaalsContact O-CB 3.29Å; E56-L60 WeakPolarHBondContact O-CB 3.49Å; E56-L60 PolarHBondContact O-N 3.17Å; E56-L158 HydrophobicContact CB-CD2 4.36Å; E56-L158 HydrophobicContact CG-CD2 4.13Å; E56-L158 WeakPolarHBondContact OE1-CB 3.02Å; E56-F188 HydrophobicContact CB-CD1 3.87Å; E56-F188 HydrophobicContact CB-CE1 4.26Å; E56-F188 VanDerWaalsContact OE2-CB 3.3Å; E56-F188 WeakPolarHBondContact OE2-CB 3.39Å; E56-F188 WeakPolarHBondContact OE2-CD1 3.49Å; E56-C189 WeakPolarHBondContact OE2-CB 3.48Å; E56-C189 PolarHBondContact OE2-N 3.21Å
57	I	90.4	Very high	86.7	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-44	175.6	-63.5	171.3	0	0	0	110.1	V37 I39 V53 W54 L60 A61 A68 V94 F188	V37-I57 HydrophobicContact CG1-CD1 4Å; V37-I57 HydrophobicContact CG2-CD1 4.47Å; V37-I57 HydrophobicContact CG2-CG2 3.99Å; I39-I57 HydrophobicContact CD1-CD1 4.16Å; V53-I57 HydrophobicContact CG1-CD1 3.98Å; V53-I57 WeakPolarHBondContact O-CG1 3.24Å; V53-I57 PolarHBondContact O-N 2.95Å; W54-I57 PolarHBondContact O-N 3.43Å; W54-I57 VanDerWaalsContact O-N 3.07Å; I57-L60 WeakPolarHBondContact O-CB 3.34Å; I57-L60 PolarHBondContact O-N 2.98Å; I57-A61 WeakPolarHBondContact O-CB 3.47Å; I57-A61 PolarHBondContact O-N 3.1Å; I57-A68 HydrophobicContact CG2-CB 4.3Å; I57-V94 HydrophobicContact CD1-CG1 4.1Å; I57-F188 HydrophobicContact CD1-CE1 4.32Å; I57-F188 HydrophobicContact CD1-CZ 4.01Å; I57-F188 HydrophobicContact CG1-CE1 3.59Å; I57-F188 HydrophobicContact CG1-CZ 3.78Å
58	E	89.4	Confident	87	Confident	85 Å²	85	54.2 Å²	54.2	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-48.8	178.5	-171.2	171.7	-131.8	0	0	111.2	W54 L60 A61 E62	W54-E58 HydrophobicContact CZ2-CB 4.23Å; W54-E58 HydrophobicContact CZ2-CG 4.3Å; W54-E58 WeakPolarHBondContact O-CB 3.48Å; W54-E58 PolarHBondContact O-N 3.49Å; E58-L60 VanDerWaalsContact C-N 3.3Å; E58-L60 PolarHBondContact O-N 3.21Å; E58-A61 WeakPolarHBondContact O-CB 3.49Å; E58-A61 PolarHBondContact O-N 3.45Å; E58-E62 PolarHBondContact O-N 3.12Å; E58-E62 VanDerWaalsContact O-N 3.12Å
59	K	87.4	Confident	87.3	Confident	138 Å²	138	54.4 Å²	54.4	60%	0.6	27%	0.272	S	S	*	.	H	α-helix	trans	-60.4	-37.3	173.6	-75.1	176.7	-177.6	178.7	0	113.3	N55 T63	N55-K59 VanDerWaalsContact O-CG 3.3Å; N55-K59 WeakPolarHBondContact O-CG 3.29Å; N55-K59 PolarHBondContact O-N 2.73Å; K59-T63 WeakPolarHBondContact O-CB 3.34Å; K59-T63 PolarHBondContact O-N 3.2Å; K59-T63 VanDerWaalsContact O-N 3.1Å; K59-T63 PolarHBondContact O-OG1 3Å
60	L	87.9	Confident	87.6	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-39.9	177.9	179.5	66.7	0	0	0	111.5	E56 I57 E58 T63 M64 M192 K193 L196	E56-L60 VanDerWaalsContact O-CB 3.29Å; E56-L60 WeakPolarHBondContact O-CB 3.49Å; E56-L60 PolarHBondContact O-N 3.17Å; I57-L60 WeakPolarHBondContact O-CB 3.34Å; I57-L60 PolarHBondContact O-N 2.98Å; E58-L60 VanDerWaalsContact C-N 3.3Å; E58-L60 PolarHBondContact O-N 3.21Å; L60-T63 PolarHBondContact O-N 3.19Å; L60-M64 HydrophobicContact CD1-CG 4Å; L60-M64 HydrophobicContact CD1-SD 3.75Å; L60-M64 HydrophobicContact CG-CG 4.48Å; L60-M64 HydrophobicContact CG-SD 4.13Å; L60-M64 PolarHBondContact O-N 3.05Å; L60-M192 HydrophobicContact CD2-CB 3.51Å; L60-M192 HydrophobicContact CD2-CG 3.26Å; L60-K193 HydrophobicContact CD1-CB 3.72Å; L60-K193 HydrophobicContact CD1-CD 4.23Å; L60-K193 HydrophobicContact CD1-CG 4.09Å; L60-L196 HydrophobicContact CD2-CD1 3.81Å; L60-L196 HydrophobicContact CG-CD1 4.34Å
61	A	85.3	Confident	87.7	Confident	8 Å²	8	56.5 Å²	56.5	7%	0.066	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-46	177.7	0	0	0	0	0	111	I57 E58 T63 M64 F65 V66 A68	I57-A61 WeakPolarHBondContact O-CB 3.47Å; I57-A61 PolarHBondContact O-N 3.1Å; E58-A61 WeakPolarHBondContact O-CB 3.49Å; E58-A61 PolarHBondContact O-N 3.45Å; A61-T63 PolarHBondContact O-N 3.34Å; A61-M64 PolarHBondContact O-N 3.13Å; A61-F65 PolarHBondContact O-N 3.2Å; A61-V66 CarbonylContact C-O 3.5Å; A61-V66 WeakPolarHBondContact CB-O 3.32Å; A61-V66 PolarHBondContact O-N 3.26Å; A61-A68 HydrophobicContact CB-CB 3.55Å
62	E	82.6	Confident	87.9	Confident	141 Å²	141	57.2 Å²	57.2	66%	0.659	29%	0.286	S	S	*	.	H	α-helix	trans	-59.4	-43.9	172.7	-68.1	178.2	169.1	0	0	112.2	E58 M64 F65	E58-E62 PolarHBondContact O-N 3.12Å; E58-E62 VanDerWaalsContact O-N 3.12Å; E62-M64 VanDerWaalsContact C-N 3.35Å; E62-M64 PolarHBondContact O-N 2.93Å; E62-F65 PolarHBondContact O-N 2.87Å
63	T	83.3	Confident	88.1	Confident	89 Å²	89	56.3 Å²	56.3	55%	0.546	28%	0.278	S	S	.	.	H	α-helix	trans	-68.6	-31.7	-177.6	-56.3	0	0	0	0	113.1	K59 L60 A61	K59-T63 WeakPolarHBondContact O-CB 3.34Å; K59-T63 PolarHBondContact O-N 3.2Å; K59-T63 VanDerWaalsContact O-N 3.1Å; K59-T63 PolarHBondContact O-OG1 3Å; L60-T63 PolarHBondContact O-N 3.19Å; A61-T63 PolarHBondContact O-N 3.34Å
64	M	80.8	Confident	88	Confident	32 Å²	32	62.2 Å²	62.2	16%	0.158	31%	0.305	C	S	.	.	H	α-helix	trans	-98.4	-0.7	-177.5	-68.6	-170.8	61.7	0	0	113.7	L60 A61 E62 V66 K193 L196 K197	L60-M64 HydrophobicContact CD1-CG 4Å; L60-M64 HydrophobicContact CD1-SD 3.75Å; L60-M64 HydrophobicContact CG-CG 4.48Å; L60-M64 HydrophobicContact CG-SD 4.13Å; L60-M64 PolarHBondContact O-N 3.05Å; A61-M64 PolarHBondContact O-N 3.13Å; E62-M64 VanDerWaalsContact C-N 3.35Å; E62-M64 PolarHBondContact O-N 2.93Å; M64-V66 VanDerWaalsContact C-N 3.3Å; M64-V66 HydrophobicContact CB-CB 4.39Å; M64-V66 HydrophobicContact CB-CG2 3.61Å; M64-K193 HydrophobicContact SD-CB 4.27Å; M64-K193 HydrophobicContact SD-CG 3.77Å; M64-L196 HydrophobicContact CE-CB 3.67Å; M64-L196 HydrophobicContact CE-CD1 4.49Å; M64-L196 HydrophobicContact SD-CB 4.06Å; M64-L196 HydrophobicContact SD-CD1 3.95Å; M64-K197 HydrophobicContact CE-CG 3.94Å
65	F	79.7	Confident	87.9	Confident	181 Å²	181	64.7 Å²	64.7	79%	0.794	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	47.1	-170.2	-57.4	-83.9	0	0	0	111.9	P32 A61 E62	P32-F65 WeakPolarHBondContact CB-O 3.48Å; A61-F65 PolarHBondContact O-N 3.2Å; E62-F65 PolarHBondContact O-N 2.87Å
66	V	84.6	Confident	87.9	Confident	14 Å²	14	61 Å²	61	9%	0.085	30%	0.297	C	S	.	.			trans	-112.7	143.9	-180	176.8	0	0	0	0	108.2	L33 I35 A61 M64	L33-V66 HydrophobicContact CB-CG1 3.69Å; L33-V66 HydrophobicContact CB-CG2 4.19Å; L33-V66 WeakPolarHBondContact O-CG1 3.14Å; I35-V66 HydrophobicContact CD1-CG1 3.42Å; I35-V66 VanDerWaalsContact CD1-CG1 3.42Å; I35-V66 HydrophobicContact CG1-CG1 3.58Å; A61-V66 CarbonylContact C-O 3.5Å; A61-V66 WeakPolarHBondContact CB-O 3.32Å; A61-V66 PolarHBondContact O-N 3.26Å; M64-V66 VanDerWaalsContact C-N 3.3Å; M64-V66 HydrophobicContact CB-CB 4.39Å; M64-V66 HydrophobicContact CB-CG2 3.61Å
67	S	85	Confident	88	Confident	38 Å²	38	63 Å²	63	27%	0.266	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.3	178.5	177.2	0	0	0	0	109.2	L33 E34 I35	L33-S67 PolarHBondContact O-N 3.19Å; E34-S67 CarbonylContact C-O 3.49Å; E34-S67 WeakPolarHBondContact CA-O 3.32Å; I35-S67 PolarHBondContact N-O 3.44Å
68	A	90.1	Very high	87.8	Confident	26 Å²	26	71.5 Å²	71.5	22%	0.215	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.8	175.1	0	0	0	0	0	110.9	I35 I57 A61	I35-A68 HydrophobicContact CB-CB 4.35Å; I35-A68 WeakPolarHBondContact O-CA 3.25Å; I57-A68 HydrophobicContact CG2-CB 4.3Å; A61-A68 HydrophobicContact CB-CB 3.55Å
69	K	90.9	Very high	87.5	Confident	78 Å²	78	68.9 Å²	68.9	34%	0.339	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.3	-178.9	-67.6	174	-178.3	158.2	0	110.4	E34 I35 V37 L86	E34-K69 IonicContact OE1-NZ 2.93Å; E34-K69 PolarHBondContact OE1-NZ 2.82Å; I35-K69 PolarHBondContact O-N 3.29Å; V37-K69 PolarHBondContact N-O 3.18Å; K69-L86 HydrophobicContact CD-CD1 4.47Å; K69-L86 HydrophobicContact CD-CD2 3.58Å
70	L	93.4	Very high	87.5	Confident	65 Å²	65	65.8 Å²	65.8	34%	0.34	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.7	172.3	-175.9	66.8	0	0	0	110.1	V37 I39 L41 W54	V37-L70 HydrophobicContact CG1-CD1 4.26Å; V37-L70 CarbonylContact O-C 3.57Å; V37-L70 WeakPolarHBondContact O-CA 3.01Å; I39-L70 HydrophobicContact CB-CD1 4.23Å; L41-L70 HydrophobicContact CD1-CD2 3.67Å; L41-L70 HydrophobicContact CG-CD2 4.41Å; W54-L70 HydrophobicContact CD2-CB 4.38Å; W54-L70 HydrophobicContact CD2-CD1 4.25Å; W54-L70 HydrophobicContact CD2-CD2 4.25Å; W54-L70 HydrophobicContact CE3-CB 4.15Å; W54-L70 HydrophobicContact CE3-CD1 3.95Å; W54-L70 HydrophobicContact CE3-CG 4.48Å; W54-L70 HydrophobicContact CH2-CB 3.67Å; W54-L70 HydrophobicContact CZ2-CB 3.9Å; W54-L70 HydrophobicContact CZ3-CB 3.8Å; W54-L70 HydrophobicContact CZ3-CD1 4.32Å
71	I	92.7	Very high	87.3	Confident	6 Å²	6	70.4 Å²	70.4	3%	0.031	36%	0.359	C	S	.	.			trans	-107.3	126.9	177.3	-57.2	177.6	0	0	0	108.2	A36 V37 V38 L76 L86 F87	A36-I71 HydrophobicContact CB-CD1 3.83Å; V37-I71 PolarHBondContact O-N 3.08Å; V38-I71 HydrophobicContact CG2-CB 4.24Å; I71-L76 HydrophobicContact CG2-CB 4.18Å; I71-L86 HydrophobicContact CD1-CB 3.87Å; I71-F87 HydrophobicContact CD1-CB 3.78Å; I71-F87 HydrophobicContact CD1-CD2 4.28Å
72	Q	91.3	Very high	87.1	Confident	101 Å²	101	74.1 Å²	74.1	47%	0.472	38%	0.383	S	S	.	.			trans	-70.6	131.4	175.8	-67.5	177.8	-15.3	0	0	110.1	E74 K75 L76	Q72-E74 VanDerWaalsContact C-N 3.34Å; Q72-E74 PolarHBondContact O-N 3.25Å; Q72-K75 HydrophobicContact CB-CB 4.39Å; Q72-K75 HydrophobicContact CB-CD 4.13Å; Q72-K75 HydrophobicContact CB-CG 4.05Å; Q72-K75 PolarHBondContact O-N 3.05Å; Q72-K75 VanDerWaalsContact O-N 3.16Å; Q72-L76 PolarHBondContact O-N 3.07Å
73	F	92.8	Very high	87.4	Confident	19 Å²	19	67.9 Å²	67.9	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-54.6	-47.5	-179.1	170.4	-102.3	0	0	0	112.1	V38 D40 K75 L76 D77 Q102 L106	V38-F73 HydrophobicContact CG1-CB 4.45Å; D40-F73 HydrophobicContact CB-CB 4.47Å; F73-K75 PolarHBondContact O-N 3.19Å; F73-L76 PolarHBondContact O-N 3.16Å; F73-D77 HydrophobicContact CE1-CB 4.04Å; F73-D77 HydrophobicContact CE2-CB 4.1Å; F73-D77 HydrophobicContact CZ-CB 3.79Å; F73-D77 WeakPolarHBondContact O-CB 3.38Å; F73-D77 PolarHBondContact O-N 3.25Å; F73-Q102 HydrophobicContact CD1-CG 3.79Å; F73-Q102 HydrophobicContact CD2-CB 4.08Å; F73-Q102 HydrophobicContact CD2-CG 4.2Å; F73-Q102 HydrophobicContact CE1-CB 4.16Å; F73-Q102 HydrophobicContact CE1-CG 3.58Å; F73-Q102 HydrophobicContact CE2-CB 3.69Å; F73-Q102 HydrophobicContact CE2-CG 4.01Å; F73-Q102 HydrophobicContact CG-CB 4.48Å; F73-Q102 HydrophobicContact CG-CG 4.11Å; F73-Q102 HydrophobicContact CZ-CB 3.73Å; F73-Q102 HydrophobicContact CZ-CG 3.7Å; F73-L106 HydrophobicContact CD2-CD1 4.27Å; F73-L106 HydrophobicContact CD2-CD2 3.84Å; F73-L106 HydrophobicContact CD2-CG 4.01Å; F73-L106 HydrophobicContact CE2-CD1 4.41Å; F73-L106 HydrophobicContact CE2-CD2 4.08Å; F73-L106 HydrophobicContact CE2-CG 3.89Å
74	E	88.9	Confident	87.6	Confident	125 Å²	125	65.3 Å²	65.3	58%	0.584	34%	0.338	S	S	*	.	H	α-helix	trans	-57	-36.9	-179.4	-64	-176.6	170.3	0	0	113.1	Q72 F78	Q72-E74 VanDerWaalsContact C-N 3.34Å; Q72-E74 PolarHBondContact O-N 3.25Å; E74-F78 WeakPolarHBondContact O-CB 3.45Å; E74-F78 PolarHBondContact O-N 3.41Å
75	K	89.8	Confident	87.6	Confident	83 Å²	83	67.9 Å²	67.9	36%	0.361	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-36.9	178.5	-65	-173.7	163.2	-158.7	0	112.4	Q72 F73 G79 E80 S83	Q72-K75 HydrophobicContact CB-CB 4.39Å; Q72-K75 HydrophobicContact CB-CD 4.13Å; Q72-K75 HydrophobicContact CB-CG 4.05Å; Q72-K75 PolarHBondContact O-N 3.05Å; Q72-K75 VanDerWaalsContact O-N 3.16Å; F73-K75 PolarHBondContact O-N 3.19Å; K75-G79 PolarHBondContact O-N 2.9Å; K75-E80 HydrophobicContact CB-CB 4.38Å; K75-E80 WeakPolarHBondContact CB-OE2 3.43Å; K75-E80 WeakPolarHBondContact CD-OE2 3.26Å; K75-E80 WeakPolarHBondContact CG-OE2 3.36Å; K75-E80 IonicContact NZ-OE2 3.76Å; K75-E80 VanDerWaalsContact O-CB 3.3Å; K75-E80 WeakPolarHBondContact O-CB 3.48Å; K75-E80 PolarHBondContact O-N 2.96Å; K75-S83 WeakPolarHBondContact CB-OG 3.44Å
76	L	90.5	Very high	88	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-70.1	-45.4	175.6	-172	67.1	0	0	0	110.7	V38 I71 Q72 F73 G79 L84 F87 L106 H109	V38-L76 HydrophobicContact CG1-CD2 4.32Å; V38-L76 HydrophobicContact CG2-CD2 3.92Å; I71-L76 HydrophobicContact CG2-CB 4.18Å; Q72-L76 PolarHBondContact O-N 3.07Å; F73-L76 PolarHBondContact O-N 3.16Å; L76-G79 WeakPolarHBondContact O-CA 3.2Å; L76-G79 PolarHBondContact O-N 2.86Å; L76-L84 HydrophobicContact CD1-CD2 3.9Å; L76-F87 HydrophobicContact CD1-CB 3.74Å; L76-F87 HydrophobicContact CD1-CD1 4.3Å; L76-F87 HydrophobicContact CD1-CG 3.96Å; L76-F87 HydrophobicContact CD2-CD2 4.22Å; L76-F87 HydrophobicContact CD2-CE2 4.49Å; L76-F87 HydrophobicContact CD2-CG 4.28Å; L76-L106 HydrophobicContact CD2-CD2 4.16Å; L76-H109 PolarHBondContact O-NE2 3.07Å
77	D	90.3	Very high	88.4	Confident	88 Å²	88	61.9 Å²	61.9	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-38.6	-179.5	-166.2	43	0	0	0	112.4	F73 G79 S105	F73-D77 HydrophobicContact CE1-CB 4.04Å; F73-D77 HydrophobicContact CE2-CB 4.1Å; F73-D77 HydrophobicContact CZ-CB 3.79Å; F73-D77 WeakPolarHBondContact O-CB 3.38Å; F73-D77 PolarHBondContact O-N 3.25Å; D77-G79 PolarHBondContact O-N 2.97Å; D77-S105 WeakPolarHBondContact OD1-CB 3.39Å; D77-S105 PolarHBondContact OD1-OG 2.84Å
78	F	86.9	Confident	88.6	Confident	181 Å²	181	61.8 Å²	61.8	79%	0.794	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.5	171.1	-169.8	-99	0	0	0	112.9	E74	E74-F78 WeakPolarHBondContact O-CB 3.45Å; E74-F78 PolarHBondContact O-N 3.41Å
79	G	83.2	Confident	88.2	Confident	31 Å²	31	65.7 Å²	65.7	32%	0.32	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	35.2	-177.4	0	0	0	0	0	113.7	K75 L76 D77 T81 L84	K75-G79 PolarHBondContact O-N 2.9Å; L76-G79 WeakPolarHBondContact O-CA 3.2Å; L76-G79 PolarHBondContact O-N 2.86Å; D77-G79 PolarHBondContact O-N 2.97Å; G79-T81 PolarHBondContact O-N 3.11Å; G79-L84 WeakPolarHBondContact O-CD1 3.49Å
80	E	87.3	Confident	87.9	Confident	73 Å²	73	62.1 Å²	62.1	34%	0.341	32%	0.324	S	S	.	.			trans	-60.5	123.7	174.8	-171.1	-177.2	165.4	0	0	110.2	K75 C82 S83 L84	K75-E80 HydrophobicContact CB-CB 4.38Å; K75-E80 WeakPolarHBondContact CB-OE2 3.43Å; K75-E80 WeakPolarHBondContact CD-OE2 3.26Å; K75-E80 WeakPolarHBondContact CG-OE2 3.36Å; K75-E80 IonicContact NZ-OE2 3.76Å; K75-E80 VanDerWaalsContact O-CB 3.3Å; K75-E80 WeakPolarHBondContact O-CB 3.48Å; K75-E80 PolarHBondContact O-N 2.96Å; E80-C82 VanDerWaalsContact C-N 3.29Å; E80-C82 PolarHBondContact O-N 3.42Å; E80-C82 VanDerWaalsContact O-N 3.16Å; E80-S83 WeakPolarHBondContact O-CB 3.33Å; E80-S83 PolarHBondContact O-N 3.46Å; E80-L84 PolarHBondContact O-N 3.03Å
81	T	83	Confident	87.5	Confident	100 Å²	100	60.1 Å²	60.1	61%	0.613	31%	0.314	S	S	*	.	H	α-helix	trans	-52.5	-44.1	-171.3	-43.5	0	0	0	0	112.9	G79 S83 L84 D85	G79-T81 PolarHBondContact O-N 3.11Å; T81-S83 VanDerWaalsContact C-N 3.34Å; T81-S83 PolarHBondContact O-N 3.3Å; T81-L84 PolarHBondContact O-N 3.5Å; T81-D85 WeakPolarHBondContact O-CB 3.42Å; T81-D85 VanDerWaalsContact O-CG 3.3Å; T81-D85 PolarHBondContact O-N 3.26Å
82	C	82.6	Confident	87.4	Confident	85 Å²	85	59.9 Å²	59.9	57%	0.574	31%	0.312	S	S	*	.	H	α-helix	trans	-63.8	-39.7	179.6	-63.7	0	0	0	0	112.2	E80 L86	E80-C82 VanDerWaalsContact C-N 3.29Å; E80-C82 PolarHBondContact O-N 3.42Å; E80-C82 VanDerWaalsContact O-N 3.16Å; C82-L86 WeakPolarHBondContact O-CB 3.43Å; C82-L86 VanDerWaalsContact O-CG 3.24Å; C82-L86 WeakPolarHBondContact O-CG 3.16Å; C82-L86 PolarHBondContact O-N 3.05Å
83	S	87.5	Confident	87.4	Confident	10 Å²	10	55 Å²	55	7%	0.07	29%	0.29	C	S	.	.	H	α-helix	trans	-71.3	-39.8	179.4	-61.5	0	0	0	0	111.5	K75 E80 T81 F87	K75-S83 WeakPolarHBondContact CB-OG 3.44Å; E80-S83 WeakPolarHBondContact O-CB 3.33Å; E80-S83 PolarHBondContact O-N 3.46Å; T81-S83 VanDerWaalsContact C-N 3.34Å; T81-S83 PolarHBondContact O-N 3.3Å; S83-F87 VanDerWaalsContact O-CB 3.31Å; S83-F87 WeakPolarHBondContact O-CB 3.16Å; S83-F87 PolarHBondContact O-N 3.38Å
84	L	87.6	Confident	87.5	Confident	35 Å²	35	54.2 Å²	54.2	18%	0.183	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-42.4	173.6	-67.8	174.3	0	0	0	111.7	L76 G79 E80 T81 F87 Y88	L76-L84 HydrophobicContact CD1-CD2 3.9Å; G79-L84 WeakPolarHBondContact O-CD1 3.49Å; E80-L84 PolarHBondContact O-N 3.03Å; T81-L84 PolarHBondContact O-N 3.5Å; L84-F87 PolarHBondContact O-N 3.45Å; L84-Y88 HydrophobicContact CB-CD2 4.11Å; L84-Y88 HydrophobicContact CB-CE2 3.96Å; L84-Y88 HydrophobicContact CD2-CE2 3.7Å; L84-Y88 HydrophobicContact CG-CE2 4.32Å; L84-Y88 WeakPolarHBondContact O-CB 3.41Å; L84-Y88 VanDerWaalsContact O-CD2 3.24Å; L84-Y88 WeakPolarHBondContact O-CD2 3.3Å; L84-Y88 PolarHBondContact O-N 3.14Å
85	D	82.2	Confident	87.7	Confident	87 Å²	87	48.2 Å²	48.2	47%	0.465	26%	0.258	S	S	.	.	H	α-helix	trans	-64.1	-42.8	177.9	-77.7	-18.6	0	0	0	111.5	T81 N89	T81-D85 WeakPolarHBondContact O-CB 3.42Å; T81-D85 VanDerWaalsContact O-CG 3.3Å; T81-D85 PolarHBondContact O-N 3.26Å; D85-N89 VanDerWaalsContact O-CB 3.26Å; D85-N89 WeakPolarHBondContact O-CB 3.4Å; D85-N89 PolarHBondContact O-N 3.37Å; D85-N89 PolarHBondContact O-ND2 3.1Å
86	L	88.1	Confident	87.8	Confident	69 Å²	69	44.4 Å²	44.4	36%	0.361	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-42.6	174.1	-72.2	174	0	0	0	111.6	K69 I71 C82 A90	K69-L86 HydrophobicContact CD-CD1 4.47Å; K69-L86 HydrophobicContact CD-CD2 3.58Å; I71-L86 HydrophobicContact CD1-CB 3.87Å; C82-L86 WeakPolarHBondContact O-CB 3.43Å; C82-L86 VanDerWaalsContact O-CG 3.24Å; C82-L86 WeakPolarHBondContact O-CG 3.16Å; C82-L86 PolarHBondContact O-N 3.05Å; L86-A90 WeakPolarHBondContact O-CB 3.41Å; L86-A90 PolarHBondContact O-N 2.96Å
87	F	92.3	Very high	87.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-73.2	-40.2	-177.5	-174.4	-98.5	0	0	0	113	A36 V38 I71 L76 S83 L84 A93 V95 H109 L110 R113	A36-F87 HydrophobicContact CB-CD2 4.12Å; V38-F87 HydrophobicContact CG2-CD2 3.78Å; V38-F87 HydrophobicContact CG2-CE2 3.75Å; I71-F87 HydrophobicContact CD1-CB 3.78Å; I71-F87 HydrophobicContact CD1-CD2 4.28Å; L76-F87 HydrophobicContact CD1-CB 3.74Å; L76-F87 HydrophobicContact CD1-CD1 4.3Å; L76-F87 HydrophobicContact CD1-CG 3.96Å; L76-F87 HydrophobicContact CD2-CD2 4.22Å; L76-F87 HydrophobicContact CD2-CE2 4.49Å; L76-F87 HydrophobicContact CD2-CG 4.28Å; S83-F87 VanDerWaalsContact O-CB 3.31Å; S83-F87 WeakPolarHBondContact O-CB 3.16Å; S83-F87 PolarHBondContact O-N 3.38Å; L84-F87 PolarHBondContact O-N 3.45Å; F87-A93 HydrophobicContact CE2-CB 3.8Å; F87-A93 HydrophobicContact CZ-CB 3.99Å; F87-V95 HydrophobicContact CE2-CG2 3.74Å; F87-V95 HydrophobicContact CZ-CG2 3.97Å; F87-H109 HydrophobicContact CD1-CB 4.18Å; F87-H109 HydrophobicContact CE1-CB 3.63Å; F87-H109 HydrophobicContact CZ-CB 4.27Å; F87-L110 HydrophobicContact CZ-CD2 4.31Å; F87-R113 HydrophobicContact CD1-CG 4.34Å; F87-R113 VanDerWaalsContact CE1-CD 3.41Å; F87-R113 HydrophobicContact CE1-CG 3.88Å; F87-R113 PolarHBondContact O-NH1 2.83Å
88	Y	88.4	Confident	87.5	Confident	35 Å²	35	40.5 Å²	40.5	14%	0.137	22%	0.222	C	C	.	.	H	α-helix	trans	-81.8	-27.4	-176.7	-65.2	-41.7	0	0	0	113.9	L84 H109 V112 R113 M116	L84-Y88 HydrophobicContact CB-CD2 4.11Å; L84-Y88 HydrophobicContact CB-CE2 3.96Å; L84-Y88 HydrophobicContact CD2-CE2 3.7Å; L84-Y88 HydrophobicContact CG-CE2 4.32Å; L84-Y88 WeakPolarHBondContact O-CB 3.41Å; L84-Y88 VanDerWaalsContact O-CD2 3.24Å; L84-Y88 WeakPolarHBondContact O-CD2 3.3Å; L84-Y88 PolarHBondContact O-N 3.14Å; Y88-H109 HydrophobicContact CE1-CB 4.5Å; Y88-H109 AromaticContact CZ-ND1 3.74Å; Y88-H109 PolarHBondContact OH-ND1 2.93Å; Y88-V112 HydrophobicContact CD1-CG1 4.13Å; Y88-V112 HydrophobicContact CE1-CB 3.8Å; Y88-V112 HydrophobicContact CE1-CG1 3.54Å; Y88-V112 HydrophobicContact CE2-CG1 4.34Å; Y88-R113 HydrophobicContact CD1-CG 3.83Å; Y88-R113 HydrophobicContact CE1-CG 4.43Å; Y88-M116 HydrophobicContact CG-CE 4.49Å
89	N	81.8	Confident	87.5	Confident	108 Å²	108	32.4 Å²	32.4	58%	0.578	19%	0.187	S	C	*	.	H	α-helix	trans	-92.3	-12.3	-178.2	-63.3	-50.8	0	0	0	114.4	D85	D85-N89 VanDerWaalsContact O-CB 3.26Å; D85-N89 WeakPolarHBondContact O-CB 3.4Å; D85-N89 PolarHBondContact O-N 3.37Å; D85-N89 PolarHBondContact O-ND2 3.1Å
90	A	86.2	Confident	87.4	Confident	3 Å²	3	34.4 Å²	34.4	3%	0.025	20%	0.196	C	C	.	.			trans	-62.2	142.5	178	0	0	0	0	0	112	E34 A36 L86 V92 R113	E34-A90 HydrophobicContact CB-CB 4.47Å; A36-A90 HydrophobicContact CB-CB 3.56Å; L86-A90 WeakPolarHBondContact O-CB 3.41Å; L86-A90 PolarHBondContact O-N 2.96Å; A90-V92 VanDerWaalsContact C-N 3.28Å; A90-V92 PolarHBondContact O-N 3.47Å; A90-R113 VanDerWaalsContact O-CZ 3.27Å; A90-R113 PolarHBondContact O-NH1 2.94Å; A90-R113 PolarHBondContact O-NH2 3.31Å
91	D	83.9	Confident	87.2	Confident	24 Å²	24	35.8 Å²	35.8	13%	0.128	21%	0.213	C	C	.	.	S	Bend	trans	-63.6	-35.4	176.5	-63.5	-68.6	0	0	0	111.7	R31 L33 E34	R31-D91 IonicContact CZ-OD1 3.45Å; R31-D91 VanDerWaalsContact CZ-OD1 3.26Å; R31-D91 IonicContact CZ-OD2 2.76Å; R31-D91 IonicContact NH1-OD1 3.56Å; R31-D91 PolarHBondContact NH1-OD1 3.36Å; R31-D91 IonicContact NH1-OD2 2.98Å; R31-D91 PolarHBondContact NH1-OD2 2.81Å; R31-D91 VanDerWaalsContact NH1-OD2 3.14Å; R31-D91 IonicContact NH2-OD1 3.68Å; R31-D91 PolarHBondContact NH2-OD1 3.35Å; L33-D91 HydrophobicContact CD2-CB 4.12Å; L33-D91 HydrophobicContact CG-CB 4.31Å; E34-D91 PolarHBondContact N-OD2 3.26Å; E34-D91 PolarHBondContact O-N 2.9Å
92	V	90.3	Very high	87.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134	178.5	178.3	0	0	0	0	110.1	L33 E34 I35 A36 A90 V94 Y120 V122 F195 L196 V199	L33-V92 HydrophobicContact CD2-CG2 3.82Å; E34-V92 PolarHBondContact O-N 3.15Å; E34-V92 VanDerWaalsContact O-N 3.1Å; I35-V92 CarbonylContact C-O 3.57Å; I35-V92 VanDerWaalsContact CA-O 3.3Å; I35-V92 WeakPolarHBondContact CA-O 3.25Å; I35-V92 HydrophobicContact CG1-CB 4.25Å; I35-V92 HydrophobicContact CG2-CB 4.39Å; I35-V92 HydrophobicContact CG2-CG1 4.36Å; A36-V92 PolarHBondContact N-O 3.08Å; A90-V92 VanDerWaalsContact C-N 3.28Å; A90-V92 PolarHBondContact O-N 3.47Å; V92-V94 HydrophobicContact CG1-CG2 4.22Å; V92-Y120 WeakPolarHBondContact CA-O 3.41Å; V92-V122 HydrophobicContact CG1-CG2 4.3Å; V92-F195 HydrophobicContact CG1-CE1 3.86Å; V92-F195 HydrophobicContact CG2-CE1 4.48Å; V92-L196 HydrophobicContact CG1-CD2 4.44Å; V92-L196 HydrophobicContact CG2-CD2 4.13Å; V92-V199 HydrophobicContact CG2-CG1 3.92Å; V92-V199 HydrophobicContact CG2-CG2 4.34Å
93	A	92.5	Very high	87.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.1	169.7	0	0	0	0	0	110.5	A36 F87 Y120 N121 V122	A36-A93 CarbonylContact O-C 3.41Å; A36-A93 WeakPolarHBondContact O-CA 3.37Å; F87-A93 HydrophobicContact CE2-CB 3.8Å; F87-A93 HydrophobicContact CZ-CB 3.99Å; A93-Y120 PolarHBondContact N-O 2.81Å; A93-N121 CarbonylContact O-C 3.59Å; A93-N121 WeakPolarHBondContact O-CA 3.13Å; A93-V122 PolarHBondContact O-N 3.43Å
94	V	93.9	Very high	87.6	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116	174.2	-175.8	0	0	0	0	108.3	I35 A36 V37 V38 I57 V92 V122 L124 M192	I35-V94 HydrophobicContact CG2-CG2 3.78Å; A36-V94 PolarHBondContact O-N 3.41Å; V37-V94 CarbonylContact C-O 3.59Å; V37-V94 WeakPolarHBondContact CA-O 3.36Å; V37-V94 HydrophobicContact CG1-CB 4.44Å; V37-V94 HydrophobicContact CG2-CB 4.29Å; V38-V94 PolarHBondContact N-O 2.9Å; I57-V94 HydrophobicContact CD1-CG1 4.1Å; V92-V94 HydrophobicContact CG1-CG2 4.22Å; V94-V122 CarbonylContact C-O 3.56Å; V94-V122 WeakPolarHBondContact CA-O 3.34Å; V94-V122 HydrophobicContact CB-CB 4.48Å; V94-V122 HydrophobicContact CG1-CB 4.37Å; V94-V122 HydrophobicContact CG1-CG1 4.42Å; V94-V122 HydrophobicContact CG2-CB 4.15Å; V94-V122 HydrophobicContact CG2-CG2 4.39Å; V94-L124 HydrophobicContact CG1-CD1 3.65Å; V94-L124 HydrophobicContact CG1-CD2 4.27Å; V94-L124 HydrophobicContact CG1-CG 3.89Å; V94-M192 HydrophobicContact CG1-CE 4.45Å; V94-M192 HydrophobicContact CG2-CE 4.44Å
95	V	93.2	Very high	87.8	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.3	-172.7	-179.9	0	0	0	0	110.2	V38 F87 L97 L106 L110 V122 V123 L124	V38-V95 HydrophobicContact CB-CG1 4.46Å; V38-V95 HydrophobicContact CB-CG2 4.35Å; V38-V95 HydrophobicContact CG2-CG2 4.3Å; F87-V95 HydrophobicContact CE2-CG2 3.74Å; F87-V95 HydrophobicContact CZ-CG2 3.97Å; V95-L97 HydrophobicContact CG1-CD2 3.9Å; V95-L97 HydrophobicContact CG1-CG 4.41Å; V95-L106 HydrophobicContact CG1-CB 3.86Å; V95-L106 HydrophobicContact CG1-CD1 3.68Å; V95-L106 HydrophobicContact CG1-CD2 3.72Å; V95-L106 HydrophobicContact CG1-CG 3.93Å; V95-L110 HydrophobicContact CG2-CD2 4.09Å; V95-L110 HydrophobicContact CG2-CG 4.46Å; V95-V122 PolarHBondContact N-O 3.2Å; V95-V123 CarbonylContact O-C 3.6Å; V95-V123 WeakPolarHBondContact O-CA 3.35Å; V95-L124 PolarHBondContact O-N 3.09Å
96	D	92.3	Very high	88.2	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.011	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	112.2	173.8	-178.4	50.9	0	0	0	111	V38 I39 R50 S98 L124 Y151	V38-D96 PolarHBondContact O-N 3.3Å; I39-D96 HydrophobicContact CB-CB 4.43Å; I39-D96 HydrophobicContact CG1-CB 3.98Å; I39-D96 HydrophobicContact CG2-CB 4.43Å; R50-D96 WeakPolarHBondContact CD-OD2 3.38Å; D96-S98 VanDerWaalsContact C-N 3.3Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.34Å; D96-S98 PolarHBondContact OD1-OG 3.36Å; D96-S98 WeakPolarHBondContact OD2-CB 3.43Å; D96-L124 HydrophobicContact CB-CB 4.3Å; D96-Y151 WeakPolarHBondContact OD1-CE1 3.45Å; D96-Y151 PolarHBondContact OD1-OH 3.36Å; D96-Y151 PolarHBondContact OD2-OH 2.91Å
97	L	89.4	Confident	88.3	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.			trans	-95.2	13.5	178.8	-65	-174	0	0	0	112.5	V95 V99 R103 L106 F107 V123 L124 Y125	V95-L97 HydrophobicContact CG1-CD2 3.9Å; V95-L97 HydrophobicContact CG1-CG 4.41Å; L97-V99 PolarHBondContact O-N 3.18Å; L97-V99 VanDerWaalsContact O-N 3.17Å; L97-R103 HydrophobicContact CB-CG 4.4Å; L97-R103 PolarHBondContact O-NE 2.9Å; L97-L106 HydrophobicContact CD2-CB 3.44Å; L97-L106 VanDerWaalsContact CD2-CB 3.44Å; L97-L106 HydrophobicContact CD2-CD1 3.66Å; L97-L106 HydrophobicContact CD2-CG 4.18Å; L97-F107 HydrophobicContact CD1-CD1 4.39Å; L97-F107 HydrophobicContact CD1-CD2 4.46Å; L97-F107 HydrophobicContact CD1-CE1 3.71Å; L97-F107 HydrophobicContact CD1-CE2 3.79Å; L97-F107 HydrophobicContact CD1-CZ 3.36Å; L97-V123 HydrophobicContact CB-CG1 4.26Å; L97-V123 HydrophobicContact CD1-CG1 3.38Å; L97-V123 HydrophobicContact CD1-CG2 4.35Å; L97-V123 HydrophobicContact CG-CG1 3.78Å; L97-L124 PolarHBondContact N-O 3.2Å; L97-Y125 HydrophobicContact CB-CD1 4.24Å; L97-Y125 HydrophobicContact CB-CE1 3.6Å; L97-Y125 HydrophobicContact CB-CE2 4.33Å; L97-Y125 HydrophobicContact CD1-CE2 4.4Å; L97-Y125 WeakPolarHBondContact CD1-OH 3.49Å
98	S	84.8	Confident	88.1	Confident	7 Å²	7	35.4 Å²	35.4	5%	0.049	19%	0.192	C	C	.	.			trans	-68.7	-6.3	-179.7	-57.9	0	0	0	0	114.2	D96 Y125 T126 E129 Y151	D96-S98 VanDerWaalsContact C-N 3.3Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.34Å; D96-S98 PolarHBondContact OD1-OG 3.36Å; D96-S98 WeakPolarHBondContact OD2-CB 3.43Å; S98-Y125 WeakPolarHBondContact OG-CA 3.47Å; S98-T126 WeakPolarHBondContact CB-OG1 3.37Å; S98-T126 PolarHBondContact OG-N 3.48Å; S98-T126 PolarHBondContact OG-OG1 2.82Å; S98-E129 WeakPolarHBondContact CA-OE2 3.42Å; S98-Y151 PolarHBondContact OG-OH 2.78Å
99	V	85.9	Confident	88.3	Confident	11 Å²	11	34.2 Å²	34.2	7%	0.067	19%	0.188	C	C	.	.	S	Bend	trans	-107.1	110.4	175.8	-174.2	0	0	0	0	108.7	V43 L97 C101 Q102	V43-V99 HydrophobicContact CB-CG2 4.41Å; V43-V99 HydrophobicContact CG1-CG1 4.46Å; V43-V99 HydrophobicContact CG1-CG2 4.35Å; V43-V99 HydrophobicContact CG2-CG1 4.2Å; V43-V99 HydrophobicContact CG2-CG2 4.33Å; L97-V99 PolarHBondContact O-N 3.18Å; L97-V99 VanDerWaalsContact O-N 3.17Å; V99-C101 VanDerWaalsContact C-N 3.34Å; V99-C101 VanDerWaalsContact CG1-SG 3.57Å; V99-C101 PolarHBondContact O-N 3.02Å; V99-Q102 HydrophobicContact CB-CB 4.25Å; V99-Q102 HydrophobicContact CB-CG 3.9Å; V99-Q102 HydrophobicContact CG1-CB 4.47Å; V99-Q102 HydrophobicContact CG1-CG 3.72Å; V99-Q102 PolarHBondContact O-N 3.19Å
100	S	81.9	Confident	88.6	Confident	72 Å²	72	29 Å²	29	50%	0.503	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-56.1	-40.4	-172	60.8	0	0	0	0	114.7	Q102	S100-Q102 VanDerWaalsContact C-N 3.27Å; S100-Q102 PolarHBondContact O-N 2.86Å
101	C	83.5	Confident	88.6	Confident	103 Å²	103	30.3 Å²	30.3	70%	0.696	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-70.5	-18.7	179.6	60.2	0	0	0	0	114.2	V99	V99-C101 VanDerWaalsContact C-N 3.34Å; V99-C101 VanDerWaalsContact CG1-SG 3.57Å; V99-C101 PolarHBondContact O-N 3.02Å
102	Q	89.8	Confident	88.7	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.037	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-91.9	-17.1	-177.1	-58.1	-178.1	1.5	0	0	112.7	D40 F73 V99 S100 T104 S105 L106	D40-Q102 PolarHBondContact OD2-NE2 3.28Å; F73-Q102 HydrophobicContact CD1-CG 3.79Å; F73-Q102 HydrophobicContact CD2-CB 4.08Å; F73-Q102 HydrophobicContact CD2-CG 4.2Å; F73-Q102 HydrophobicContact CE1-CB 4.16Å; F73-Q102 HydrophobicContact CE1-CG 3.58Å; F73-Q102 HydrophobicContact CE2-CB 3.69Å; F73-Q102 HydrophobicContact CE2-CG 4.01Å; F73-Q102 HydrophobicContact CG-CB 4.48Å; F73-Q102 HydrophobicContact CG-CG 4.11Å; F73-Q102 HydrophobicContact CZ-CB 3.73Å; F73-Q102 HydrophobicContact CZ-CG 3.7Å; V99-Q102 HydrophobicContact CB-CB 4.25Å; V99-Q102 HydrophobicContact CB-CG 3.9Å; V99-Q102 HydrophobicContact CG1-CB 4.47Å; V99-Q102 HydrophobicContact CG1-CG 3.72Å; V99-Q102 PolarHBondContact O-N 3.19Å; S100-Q102 VanDerWaalsContact C-N 3.27Å; S100-Q102 PolarHBondContact O-N 2.86Å; Q102-T104 VanDerWaalsContact C-N 3.34Å; Q102-T104 PolarHBondContact O-N 2.92Å; Q102-S105 PolarHBondContact O-N 3.23Å; Q102-L106 HydrophobicContact CB-CD1 3.89Å; Q102-L106 HydrophobicContact CB-CG 4.46Å; Q102-L106 WeakPolarHBondContact O-CG 3.34Å; Q102-L106 PolarHBondContact O-N 3.37Å
103	R	86.5	Confident	88.6	Confident	22 Å²	22	30.5 Å²	30.5	8%	0.083	18%	0.175	C	C	.	.	H	α-helix	trans	-54.6	-45.9	-171.7	-66	178.9	-174	145.6	11.1	112.8	L97 S105 L106 F107 E129 E132 I135	L97-R103 HydrophobicContact CB-CG 4.4Å; L97-R103 PolarHBondContact O-NE 2.9Å; R103-S105 PolarHBondContact O-N 3.26Å; R103-L106 PolarHBondContact O-N 3.04Å; R103-F107 HydrophobicContact CB-CD2 4.33Å; R103-F107 HydrophobicContact CB-CE2 4.36Å; R103-F107 WeakPolarHBondContact O-CB 3.24Å; R103-F107 WeakPolarHBondContact O-CD2 3.44Å; R103-F107 PolarHBondContact O-N 3.35Å; R103-E129 IonicContact CZ-OE2 2.82Å; R103-E129 IonicContact NH2-OE1 2.73Å; R103-E129 PolarHBondContact NH2-OE1 3.1Å; R103-E129 IonicContact NH2-OE2 3.04Å; R103-E129 PolarHBondContact NH2-OE2 2.76Å; R103-E132 IonicContact CZ-OE2 2.98Å; R103-E132 IonicContact NH1-OE2 3.3Å; R103-E132 PolarHBondContact NH1-OE2 2.87Å; R103-E132 IonicContact NH2-OE2 3.77Å; R103-E132 PolarHBondContact NH2-OE2 3.37Å; R103-I135 VanDerWaalsContact CZ-CD1 3.45Å
104	T	85.2	Confident	87.9	Confident	119 Å²	119	34.3 Å²	34.3	73%	0.73	19%	0.193	S	C	*	.	H	α-helix	trans	-61.1	-45.1	-176.6	-51.4	0	0	0	0	112.3	Q102 Y108	Q102-T104 VanDerWaalsContact C-N 3.34Å; Q102-T104 PolarHBondContact O-N 2.92Å; T104-Y108 PolarHBondContact O-N 3.25Å; T104-Y108 VanDerWaalsContact O-N 3.15Å
105	S	91.1	Very high	87	Confident	21 Å²	21	38.9 Å²	38.9	15%	0.147	23%	0.226	C	C	.	.	H	α-helix	trans	-69	-45.5	179.6	176.8	0	0	0	0	111.5	D77 Q102 R103 F107 Y108 H109	D77-S105 WeakPolarHBondContact OD1-CB 3.39Å; D77-S105 PolarHBondContact OD1-OG 2.84Å; Q102-S105 PolarHBondContact O-N 3.23Å; R103-S105 PolarHBondContact O-N 3.26Å; S105-F107 PolarHBondContact O-N 3.09Å; S105-Y108 VanDerWaalsContact O-CB 3.31Å; S105-Y108 WeakPolarHBondContact O-CB 3.37Å; S105-Y108 PolarHBondContact O-N 3.49Å; S105-Y108 VanDerWaalsContact O-N 3.07Å; S105-H109 PolarHBondContact O-CD2 2.99Å; S105-H109 PolarHBondContact O-N 3.27Å; S105-H109 VanDerWaalsContact O-N 3.1Å
106	L	92	Very high	86.2	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-39.9	178.4	-69.2	174.3	0	0	0	112.6	V38 F73 L76 V95 L97 Q102 R103 Y108 H109 L110	V38-L106 HydrophobicContact CB-CD2 4.43Å; V38-L106 HydrophobicContact CG1-CD2 3.77Å; F73-L106 HydrophobicContact CD2-CD1 4.27Å; F73-L106 HydrophobicContact CD2-CD2 3.84Å; F73-L106 HydrophobicContact CD2-CG 4.01Å; F73-L106 HydrophobicContact CE2-CD1 4.41Å; F73-L106 HydrophobicContact CE2-CD2 4.08Å; F73-L106 HydrophobicContact CE2-CG 3.89Å; L76-L106 HydrophobicContact CD2-CD2 4.16Å; V95-L106 HydrophobicContact CG1-CB 3.86Å; V95-L106 HydrophobicContact CG1-CD1 3.68Å; V95-L106 HydrophobicContact CG1-CD2 3.72Å; V95-L106 HydrophobicContact CG1-CG 3.93Å; L97-L106 HydrophobicContact CD2-CB 3.44Å; L97-L106 VanDerWaalsContact CD2-CB 3.44Å; L97-L106 HydrophobicContact CD2-CD1 3.66Å; L97-L106 HydrophobicContact CD2-CG 4.18Å; Q102-L106 HydrophobicContact CB-CD1 3.89Å; Q102-L106 HydrophobicContact CB-CG 4.46Å; Q102-L106 WeakPolarHBondContact O-CG 3.34Å; Q102-L106 PolarHBondContact O-N 3.37Å; R103-L106 PolarHBondContact O-N 3.04Å; L106-Y108 VanDerWaalsContact C-N 3.32Å; L106-Y108 PolarHBondContact O-N 3.11Å; L106-H109 PolarHBondContact O-N 3.21Å; L106-L110 WeakPolarHBondContact O-CB 3.46Å; L106-L110 WeakPolarHBondContact O-CG 3.44Å; L106-L110 PolarHBondContact O-N 3.27Å
107	F	88.7	Confident	85.3	Confident	50 Å²	50	47.9 Å²	47.9	22%	0.219	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-35.2	172.7	-83.5	-57.1	0	0	0	112.8	L97 R103 S105 L110 G111 L138 F143	L97-F107 HydrophobicContact CD1-CD1 4.39Å; L97-F107 HydrophobicContact CD1-CD2 4.46Å; L97-F107 HydrophobicContact CD1-CE1 3.71Å; L97-F107 HydrophobicContact CD1-CE2 3.79Å; L97-F107 HydrophobicContact CD1-CZ 3.36Å; R103-F107 HydrophobicContact CB-CD2 4.33Å; R103-F107 HydrophobicContact CB-CE2 4.36Å; R103-F107 WeakPolarHBondContact O-CB 3.24Å; R103-F107 WeakPolarHBondContact O-CD2 3.44Å; R103-F107 PolarHBondContact O-N 3.35Å; S105-F107 PolarHBondContact O-N 3.09Å; F107-L110 HydrophobicContact CD1-CD1 4.4Å; F107-L110 PolarHBondContact O-N 3.23Å; F107-G111 PolarHBondContact O-N 2.81Å; F107-L138 HydrophobicContact CE2-CD2 4.39Å; F107-L138 HydrophobicContact CZ-CD2 4.04Å; F107-F143 HydrophobicContact CD1-CZ 4.4Å; F107-F143 AromaticContact CE1-CE1 3.9Å; F107-F143 HydrophobicContact CE1-CE1 3.9Å; F107-F143 AromaticContact CE1-CE2 3.84Å; F107-F143 HydrophobicContact CE1-CE2 3.84Å; F107-F143 AromaticContact CE1-CZ 3.37Å; F107-F143 HydrophobicContact CE1-CZ 3.37Å; F107-F143 HydrophobicContact CE2-CZ 4.45Å; F107-F143 HydrophobicContact CZ-CE1 4.33Å; F107-F143 AromaticContact CZ-CE2 3.77Å; F107-F143 HydrophobicContact CZ-CE2 3.77Å; F107-F143 AromaticContact CZ-CZ 3.41Å; F107-F143 HydrophobicContact CZ-CZ 3.41Å; F107-F143 VanDerWaalsContact CZ-CZ 3.41Å
108	Y	89.6	Confident	84.7	Confident	156 Å²	156	50.8 Å²	50.8	61%	0.612	29%	0.285	S	S	*	.	H	α-helix	trans	-60.8	-50	173.6	172.2	-96.6	0	0	0	111.2	T104 S105 L106 L110 G111 V112	T104-Y108 PolarHBondContact O-N 3.25Å; T104-Y108 VanDerWaalsContact O-N 3.15Å; S105-Y108 VanDerWaalsContact O-CB 3.31Å; S105-Y108 WeakPolarHBondContact O-CB 3.37Å; S105-Y108 PolarHBondContact O-N 3.49Å; S105-Y108 VanDerWaalsContact O-N 3.07Å; L106-Y108 VanDerWaalsContact C-N 3.32Å; L106-Y108 PolarHBondContact O-N 3.11Å; Y108-L110 VanDerWaalsContact C-N 3.35Å; Y108-L110 PolarHBondContact O-N 2.87Å; Y108-G111 PolarHBondContact O-N 2.88Å; Y108-V112 HydrophobicContact CD1-CG2 4.46Å; Y108-V112 HydrophobicContact CE1-CG2 4.06Å; Y108-V112 HydrophobicContact CE2-CG2 4.44Å; Y108-V112 WeakPolarHBondContact O-CG2 3.34Å; Y108-V112 PolarHBondContact O-N 3.19Å
109	H	91.7	Very high	84.3	Confident	10 Å²	10	56.3 Å²	56.3	5%	0.046	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-37.1	178.8	-69.4	-66.8	0	0	0	113.2	L76 F87 Y88 S105 L106 V112 R113	L76-H109 PolarHBondContact O-NE2 3.07Å; F87-H109 HydrophobicContact CD1-CB 4.18Å; F87-H109 HydrophobicContact CE1-CB 3.63Å; F87-H109 HydrophobicContact CZ-CB 4.27Å; Y88-H109 HydrophobicContact CE1-CB 4.5Å; Y88-H109 AromaticContact CZ-ND1 3.74Å; Y88-H109 PolarHBondContact OH-ND1 2.93Å; S105-H109 PolarHBondContact O-CD2 2.99Å; S105-H109 PolarHBondContact O-N 3.27Å; S105-H109 VanDerWaalsContact O-N 3.1Å; L106-H109 PolarHBondContact O-N 3.21Å; H109-V112 PolarHBondContact O-N 3.16Å; H109-R113 PolarHBondContact O-N 2.78Å
110	L	89	Confident	84.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-42.3	172.9	-73.8	171.9	0	0	0	112.1	F87 V95 L106 F107 Y108 V112 R113 E114 N121 V123 Y146	F87-L110 HydrophobicContact CZ-CD2 4.31Å; V95-L110 HydrophobicContact CG2-CD2 4.09Å; V95-L110 HydrophobicContact CG2-CG 4.46Å; L106-L110 WeakPolarHBondContact O-CB 3.46Å; L106-L110 WeakPolarHBondContact O-CG 3.44Å; L106-L110 PolarHBondContact O-N 3.27Å; F107-L110 HydrophobicContact CD1-CD1 4.4Å; F107-L110 PolarHBondContact O-N 3.23Å; Y108-L110 VanDerWaalsContact C-N 3.35Å; Y108-L110 PolarHBondContact O-N 2.87Å; L110-V112 VanDerWaalsContact C-N 3.32Å; L110-V112 PolarHBondContact O-N 3.49Å; L110-R113 WeakPolarHBondContact O-CB 3.42Å; L110-R113 PolarHBondContact O-N 3.48Å; L110-E114 PolarHBondContact O-N 3.37Å; L110-N121 HydrophobicContact CD2-CB 3.68Å; L110-V123 HydrophobicContact CD1-CG2 4.01Å; L110-Y146 HydrophobicContact CB-CE1 4.46Å
111	G	85.1	Confident	84.7	Confident	30 Å²	30	54.8 Å²	54.8	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-64.3	-34.3	174.4	0	0	0	0	0	113.2	F107 Y108 E114 S115	F107-G111 PolarHBondContact O-N 2.81Å; Y108-G111 PolarHBondContact O-N 2.88Å; G111-E114 PolarHBondContact O-N 3.46Å; G111-S115 PolarHBondContact O-N 3.07Å
112	V	86	Confident	85	Confident	27 Å²	27	49.9 Å²	49.9	16%	0.164	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-46.1	172.2	175.1	0	0	0	0	110.6	Y88 Y108 H109 L110 E114 S115 M116	Y88-V112 HydrophobicContact CD1-CG1 4.13Å; Y88-V112 HydrophobicContact CE1-CB 3.8Å; Y88-V112 HydrophobicContact CE1-CG1 3.54Å; Y88-V112 HydrophobicContact CE2-CG1 4.34Å; Y108-V112 HydrophobicContact CD1-CG2 4.46Å; Y108-V112 HydrophobicContact CE1-CG2 4.06Å; Y108-V112 HydrophobicContact CE2-CG2 4.44Å; Y108-V112 WeakPolarHBondContact O-CG2 3.34Å; Y108-V112 PolarHBondContact O-N 3.19Å; H109-V112 PolarHBondContact O-N 3.16Å; L110-V112 VanDerWaalsContact C-N 3.32Å; L110-V112 PolarHBondContact O-N 3.49Å; V112-E114 VanDerWaalsContact C-N 3.33Å; V112-E114 PolarHBondContact O-N 2.89Å; V112-S115 PolarHBondContact O-N 2.76Å; V112-S115 VanDerWaalsContact O-N 3.16Å; V112-S115 PolarHBondContact O-OG 3.22Å; V112-M116 HydrophobicContact CG1-CE 3.75Å; V112-M116 WeakPolarHBondContact O-CG 3Å; V112-M116 PolarHBondContact O-N 3.2Å; V112-M116 VanDerWaalsContact O-N 3.16Å
113	R	87.5	Confident	85	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.8	-44.9	173.8	-79.3	-171.6	62	107	6.8	111.7	F87 Y88 A90 H109 L110 S115 M116 D117 Q118 N121	F87-R113 HydrophobicContact CD1-CG 4.34Å; F87-R113 VanDerWaalsContact CE1-CD 3.41Å; F87-R113 HydrophobicContact CE1-CG 3.88Å; F87-R113 PolarHBondContact O-NH1 2.83Å; Y88-R113 HydrophobicContact CD1-CG 3.83Å; Y88-R113 HydrophobicContact CE1-CG 4.43Å; A90-R113 VanDerWaalsContact O-CZ 3.27Å; A90-R113 PolarHBondContact O-NH1 2.94Å; A90-R113 PolarHBondContact O-NH2 3.31Å; H109-R113 PolarHBondContact O-N 2.78Å; L110-R113 WeakPolarHBondContact O-CB 3.42Å; L110-R113 PolarHBondContact O-N 3.48Å; R113-S115 VanDerWaalsContact C-N 3.3Å; R113-S115 PolarHBondContact O-N 2.62Å; R113-M116 CarbonylContact O-C 3.52Å; R113-M116 WeakPolarHBondContact O-CA 3.21Å; R113-M116 WeakPolarHBondContact O-CB 3.49Å; R113-M116 PolarHBondContact O-N 2.91Å; R113-D117 PolarHBondContact O-N 3.45Å; R113-Q118 HydrophobicContact CB-CB 3.97Å; R113-Q118 HydrophobicContact CG-CB 4.47Å; R113-Q118 VanDerWaalsContact O-CB 3.31Å; R113-Q118 WeakPolarHBondContact O-CB 3.27Å; R113-Q118 PolarHBondContact O-N 2.9Å; R113-N121 PolarHBondContact NE-OD1 2.69Å
114	E	79.7	Confident	85.1	Confident	80 Å²	80	48.5 Å²	48.5	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-58.6	-41.6	176.1	-173.6	173.7	-177.5	0	0	112	L110 G111 V112 M116 D117 N145 Y146	L110-E114 PolarHBondContact O-N 3.37Å; G111-E114 PolarHBondContact O-N 3.46Å; V112-E114 VanDerWaalsContact C-N 3.33Å; V112-E114 PolarHBondContact O-N 2.89Å; E114-M116 PolarHBondContact O-N 3.11Å; E114-D117 PolarHBondContact O-N 2.93Å; E114-N145 PolarHBondContact OE1-ND2 2.76Å; E114-Y146 PolarHBondContact OE2-OH 2.86Å
115	S	74.8	Confident	85.2	Confident	98 Å²	98	42.9 Å²	42.9	69%	0.685	22%	0.218	S	C	*	.	H	α-helix	trans	-64.9	-23.1	175.2	80.2	0	0	0	0	113.9	G111 V112 R113 D117	G111-S115 PolarHBondContact O-N 3.07Å; V112-S115 PolarHBondContact O-N 2.76Å; V112-S115 VanDerWaalsContact O-N 3.16Å; V112-S115 PolarHBondContact O-OG 3.22Å; R113-S115 VanDerWaalsContact C-N 3.3Å; R113-S115 PolarHBondContact O-N 2.62Å; S115-D117 VanDerWaalsContact C-N 3.28Å
116	M	75.4	Confident	84.8	Confident	99 Å²	99	42.5 Å²	42.5	49%	0.488	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	10.3	173.4	-62.6	-178.7	-178	0	0	112.9	Y88 V112 R113 E114 Q118	Y88-M116 HydrophobicContact CG-CE 4.49Å; V112-M116 HydrophobicContact CG1-CE 3.75Å; V112-M116 WeakPolarHBondContact O-CG 3Å; V112-M116 PolarHBondContact O-N 3.2Å; V112-M116 VanDerWaalsContact O-N 3.16Å; R113-M116 CarbonylContact O-C 3.52Å; R113-M116 WeakPolarHBondContact O-CA 3.21Å; R113-M116 WeakPolarHBondContact O-CB 3.49Å; R113-M116 PolarHBondContact O-N 2.91Å; E114-M116 PolarHBondContact O-N 3.11Å; M116-Q118 HydrophobicContact CB-CG 4.1Å; M116-Q118 PolarHBondContact O-N 2.8Å
117	D	72.8	Confident	83.9	Confident	91 Å²	91	44.8 Å²	44.8	49%	0.487	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	23.9	-174.5	-153.5	44.2	0	0	0	113.4	R113 E114 S115 K119	R113-D117 PolarHBondContact O-N 3.45Å; E114-D117 PolarHBondContact O-N 2.93Å; S115-D117 VanDerWaalsContact C-N 3.28Å; D117-K119 VanDerWaalsContact CG-CE 3.5Å; D117-K119 PolarHBondContact O-N 2.69Å; D117-K119 WeakPolarHBondContact OD1-CE 3.48Å; D117-K119 IonicContact OD1-NZ 2.69Å; D117-K119 PolarHBondContact OD1-NZ 2.7Å; D117-K119 VanDerWaalsContact OD1-NZ 3.09Å; D117-K119 IonicContact OD2-NZ 2.72Å; D117-K119 PolarHBondContact OD2-NZ 3.01Å
118	Q	77.4	Confident	83	Confident	61 Å²	61	49.6 Å²	49.6	29%	0.285	25%	0.249	S	C	.	.			trans	-83.4	92.6	174.8	-66.2	-70	-37.6	0	0	109.8	R113 M116 N121	R113-Q118 HydrophobicContact CB-CB 3.97Å; R113-Q118 HydrophobicContact CG-CB 4.47Å; R113-Q118 VanDerWaalsContact O-CB 3.31Å; R113-Q118 WeakPolarHBondContact O-CB 3.27Å; R113-Q118 PolarHBondContact O-N 2.9Å; M116-Q118 HydrophobicContact CB-CG 4.1Å; M116-Q118 PolarHBondContact O-N 2.8Å; Q118-N121 PolarHBondContact O-ND2 3.34Å
119	K	76	Confident	81.8	Confident	123 Å²	123	44 Å²	44	54%	0.535	23%	0.228	S	C	.	.			trans	-81.3	-23.1	-168.3	-66.4	173	-172.6	156.2	0	115.2	D117 N121	D117-K119 VanDerWaalsContact CG-CE 3.5Å; D117-K119 PolarHBondContact O-N 2.69Å; D117-K119 WeakPolarHBondContact OD1-CE 3.48Å; D117-K119 IonicContact OD1-NZ 2.69Å; D117-K119 PolarHBondContact OD1-NZ 2.7Å; D117-K119 VanDerWaalsContact OD1-NZ 3.09Å; D117-K119 IonicContact OD2-NZ 2.72Å; D117-K119 PolarHBondContact OD2-NZ 3.01Å; K119-N121 PolarHBondContact O-N 3.41Å
120	Y	87.3	Confident	80.4	Confident	49 Å²	49	44 Å²	44	19%	0.192	23%	0.229	C	C	.	.			trans	-88.9	76.2	-170.8	-52.5	-64.9	0	0	0	112.3	V92 A93 V199 E202	V92-Y120 WeakPolarHBondContact CA-O 3.41Å; A93-Y120 PolarHBondContact N-O 2.81Å; Y120-V199 HydrophobicContact CD1-CB 4.3Å; Y120-V199 HydrophobicContact CD1-CG1 4.01Å; Y120-V199 HydrophobicContact CD1-CG2 3.53Å; Y120-V199 HydrophobicContact CD2-CG1 3.57Å; Y120-V199 HydrophobicContact CE1-CB 4.36Å; Y120-V199 HydrophobicContact CE1-CG1 4.15Å; Y120-V199 HydrophobicContact CE1-CG2 3.92Å; Y120-V199 HydrophobicContact CE2-CG1 3.73Å; Y120-V199 HydrophobicContact CG-CB 4.43Å; Y120-V199 HydrophobicContact CG-CG1 3.7Å; Y120-V199 HydrophobicContact CG-CG2 3.88Å; Y120-E202 WeakPolarHBondContact CE1-OE2 3.13Å; Y120-E202 WeakPolarHBondContact OH-CB 3.32Å; Y120-E202 PolarHBondContact OH-OE2 3.4Å; Y120-E202 VanDerWaalsContact OH-OE2 3.1Å
121	N	89.3	Confident	79	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.4	176.5	-46.1	-65.2	0	0	0	110.7	A93 L110 R113 Q118 K119 Y146 K147	A93-N121 CarbonylContact O-C 3.59Å; A93-N121 WeakPolarHBondContact O-CA 3.13Å; L110-N121 HydrophobicContact CD2-CB 3.68Å; R113-N121 PolarHBondContact NE-OD1 2.69Å; Q118-N121 PolarHBondContact O-ND2 3.34Å; K119-N121 PolarHBondContact O-N 3.41Å; N121-Y146 HydrophobicContact CB-CD1 3.86Å; N121-Y146 HydrophobicContact CB-CE1 4.34Å; N121-K147 PolarHBondContact O-N 2.76Å
122	V	90.3	Very high	77.9	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.5	178	-175.3	0	0	0	0	108.9	V92 A93 V94 V95 L124 K147 L149 M192 F195	V92-V122 HydrophobicContact CG1-CG2 4.3Å; A93-V122 PolarHBondContact O-N 3.43Å; V94-V122 CarbonylContact C-O 3.56Å; V94-V122 WeakPolarHBondContact CA-O 3.34Å; V94-V122 HydrophobicContact CB-CB 4.48Å; V94-V122 HydrophobicContact CG1-CB 4.37Å; V94-V122 HydrophobicContact CG1-CG1 4.42Å; V94-V122 HydrophobicContact CG2-CB 4.15Å; V94-V122 HydrophobicContact CG2-CG2 4.39Å; V95-V122 PolarHBondContact N-O 3.2Å; V122-L124 HydrophobicContact CG1-CD2 3.9Å; V122-K147 CarbonylContact C-O 3.53Å; V122-K147 WeakPolarHBondContact CA-O 3.48Å; V122-K147 HydrophobicContact CG2-CB 4.33Å; V122-L149 HydrophobicContact CG1-CD1 3.83Å; V122-L149 HydrophobicContact CG1-CG 4.2Å; V122-M192 HydrophobicContact CG1-CE 4.26Å; V122-F195 HydrophobicContact CG2-CD1 3.86Å; V122-F195 HydrophobicContact CG2-CE1 3.27Å; V122-F195 HydrophobicContact CG2-CE2 4.46Å; V122-F195 HydrophobicContact CG2-CZ 3.62Å
123	V	89.6	Confident	76.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127	179.5	171.3	0	0	0	0	109	V95 L97 L110 Y125 Y146 K147 T148 L149	V95-V123 CarbonylContact O-C 3.6Å; V95-V123 WeakPolarHBondContact O-CA 3.35Å; L97-V123 HydrophobicContact CB-CG1 4.26Å; L97-V123 HydrophobicContact CD1-CG1 3.38Å; L97-V123 HydrophobicContact CD1-CG2 4.35Å; L97-V123 HydrophobicContact CG-CG1 3.78Å; L110-V123 HydrophobicContact CD1-CG2 4.01Å; V123-Y125 HydrophobicContact CG1-CD2 4.02Å; V123-Y125 HydrophobicContact CG1-CE2 3.56Å; V123-Y146 HydrophobicContact CG2-CG 4.41Å; V123-K147 PolarHBondContact N-O 2.8Å; V123-T148 HydrophobicContact CG1-CG2 4.46Å; V123-T148 CarbonylContact O-C 3.58Å; V123-T148 WeakPolarHBondContact O-CA 3.28Å; V123-L149 PolarHBondContact O-N 2.79Å
124	L	89.6	Confident	75.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.7	-179.9	-49.3	-178.2	0	0	0	111.5	V53 V94 V95 D96 L97 V122 L149 Y151 F188	V53-L124 HydrophobicContact CG1-CD1 3.66Å; V94-L124 HydrophobicContact CG1-CD1 3.65Å; V94-L124 HydrophobicContact CG1-CD2 4.27Å; V94-L124 HydrophobicContact CG1-CG 3.89Å; V95-L124 PolarHBondContact O-N 3.09Å; D96-L124 HydrophobicContact CB-CB 4.3Å; L97-L124 PolarHBondContact N-O 3.2Å; V122-L124 HydrophobicContact CG1-CD2 3.9Å; L124-L149 WeakPolarHBondContact CA-O 3.39Å; L124-L149 HydrophobicContact CD2-CB 3.83Å; L124-L149 HydrophobicContact CD2-CD1 4.08Å; L124-L149 HydrophobicContact CD2-CG 4.43Å; L124-Y151 HydrophobicContact CB-CD1 3.92Å; L124-Y151 HydrophobicContact CB-CE1 3.67Å; L124-F188 HydrophobicContact CD1-CE2 4.39Å; L124-F188 HydrophobicContact CD2-CE2 4.1Å
125	Y	85.7	Confident	74.4	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.008	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.6	172.3	-77.1	-77	0	0	0	111.6	L97 S98 V123 I135 L139 T148 L149 L150 Y151	L97-Y125 HydrophobicContact CB-CD1 4.24Å; L97-Y125 HydrophobicContact CB-CE1 3.6Å; L97-Y125 HydrophobicContact CB-CE2 4.33Å; L97-Y125 HydrophobicContact CD1-CE2 4.4Å; L97-Y125 WeakPolarHBondContact CD1-OH 3.49Å; S98-Y125 WeakPolarHBondContact OG-CA 3.47Å; V123-Y125 HydrophobicContact CG1-CD2 4.02Å; V123-Y125 HydrophobicContact CG1-CE2 3.56Å; Y125-I135 HydrophobicContact CD1-CD1 4.39Å; Y125-I135 HydrophobicContact CD1-CG2 4.32Å; Y125-I135 HydrophobicContact CE1-CD1 4.32Å; Y125-I135 HydrophobicContact CE1-CG2 4.24Å; Y125-L139 HydrophobicContact CD2-CD2 4.24Å; Y125-L139 HydrophobicContact CE2-CD2 4.28Å; Y125-T148 HydrophobicContact CD2-CG2 3.82Å; Y125-T148 HydrophobicContact CE2-CG2 4.07Å; Y125-L149 PolarHBondContact N-O 2.86Å; Y125-L150 CarbonylContact O-C 3.5Å; Y125-L150 WeakPolarHBondContact O-CA 3.35Å; Y125-Y151 WeakPolarHBondContact O-CD1 3.38Å; Y125-Y151 WeakPolarHBondContact O-CE1 3.28Å; Y125-Y151 PolarHBondContact O-N 2.89Å
126	T	82.9	Confident	73.7	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.074	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	137	169.2	-27.6	0	0	0	0	110.3	L49 S98 E128 E129 Y151	L49-T126 HydrophobicContact CD2-CG2 3.9Å; S98-T126 WeakPolarHBondContact CB-OG1 3.37Å; S98-T126 PolarHBondContact OG-N 3.48Å; S98-T126 PolarHBondContact OG-OG1 2.82Å; T126-E128 PolarHBondContact O-N 3.01Å; T126-E128 VanDerWaalsContact O-N 3.14Å; T126-E129 PolarHBondContact O-N 3.15Å; T126-E129 VanDerWaalsContact O-N 3.1Å; T126-Y151 HydrophobicContact CG2-CE2 4.08Å
127	M	73.8	Confident	72.8	Confident	50 Å²	50	55.6 Å²	55.6	25%	0.246	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-57.3	-28.3	177.3	-89.2	-72.3	-164.8	0	0	114.2	E129 V130 L150 Y151 A152 F161 V166	M127-E129 VanDerWaalsContact C-N 3.25Å; M127-E129 PolarHBondContact O-N 2.69Å; M127-V130 PolarHBondContact O-N 3.45Å; M127-V130 HydrophobicContact SD-CG2 4.33Å; M127-L150 HydrophobicContact CE-CB 3.95Å; M127-L150 HydrophobicContact CE-CD1 4.17Å; M127-L150 HydrophobicContact CG-CB 4.36Å; M127-L150 HydrophobicContact SD-CB 4.15Å; M127-L150 HydrophobicContact SD-CD1 4.24Å; M127-L150 HydrophobicContact SD-CD2 4.43Å; M127-Y151 PolarHBondContact N-O 3.48Å; M127-A152 HydrophobicContact CB-CB 3.89Å; M127-A152 HydrophobicContact CG-CB 3.8Å; M127-F161 HydrophobicContact CE-CB 4.03Å; M127-F161 HydrophobicContact CE-CD2 3.25Å; M127-F161 HydrophobicContact CE-CE2 3.75Å; M127-F161 HydrophobicContact CE-CG 3.69Å; M127-V166 HydrophobicContact CE-CG1 4.13Å; M127-V166 HydrophobicContact CE-CG2 4.41Å
128	E	69	Low	72	Confident	150 Å²	150	53.8 Å²	53.8	70%	0.701	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-62.1	-33.7	178	-69.1	-176.3	168.5	0	0	112.4	T126 V130	T126-E128 PolarHBondContact O-N 3.01Å; T126-E128 VanDerWaalsContact O-N 3.14Å; E128-V130 VanDerWaalsContact C-N 3.34Å; E128-V130 PolarHBondContact O-N 3.17Å
129	E	65.1	Low	71.2	Confident	40 Å²	40	51.5 Å²	51.5	19%	0.187	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-79.7	-13.4	-176.5	-60	-153.4	123	0	0	114	S98 R103 T126 M127 R131 E132 I135	S98-E129 WeakPolarHBondContact CA-OE2 3.42Å; R103-E129 IonicContact CZ-OE2 2.82Å; R103-E129 IonicContact NH2-OE1 2.73Å; R103-E129 PolarHBondContact NH2-OE1 3.1Å; R103-E129 IonicContact NH2-OE2 3.04Å; R103-E129 PolarHBondContact NH2-OE2 2.76Å; T126-E129 PolarHBondContact O-N 3.15Å; T126-E129 VanDerWaalsContact O-N 3.1Å; M127-E129 VanDerWaalsContact C-N 3.25Å; M127-E129 PolarHBondContact O-N 2.69Å; E129-R131 PolarHBondContact O-N 3.44Å; E129-E132 VanDerWaalsContact O-CB 3.26Å; E129-E132 WeakPolarHBondContact O-CB 3.09Å; E129-E132 PolarHBondContact O-N 3.05Å; E129-I135 HydrophobicContact CB-CD1 3.41Å; E129-I135 VanDerWaalsContact CB-CD1 3.41Å; E129-I135 HydrophobicContact CG-CD1 4.3Å; E129-I135 WeakPolarHBondContact O-CD1 3.49Å; E129-I135 WeakPolarHBondContact OE2-CD1 3.41Å
130	V	62.1	Low	70.2	Confident	10 Å²	10	51.1 Å²	51.1	6%	0.061	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-60.5	-19.4	176.4	-176	0	0	0	0	112	M127 E128 E132 L139 L150 I170	M127-V130 PolarHBondContact O-N 3.45Å; M127-V130 HydrophobicContact SD-CG2 4.33Å; E128-V130 VanDerWaalsContact C-N 3.34Å; E128-V130 PolarHBondContact O-N 3.17Å; V130-E132 VanDerWaalsContact C-N 3.29Å; V130-L139 HydrophobicContact CB-CD1 4.45Å; V130-L139 HydrophobicContact CG1-CD1 3.96Å; V130-L139 HydrophobicContact CG2-CD1 4.05Å; V130-L150 HydrophobicContact CG2-CD1 4.34Å; V130-L150 HydrophobicContact CG2-CD2 3.3Å; V130-L150 HydrophobicContact CG2-CG 4.46Å; V130-I170 HydrophobicContact CG1-CD1 3.72Å; V130-I170 HydrophobicContact CG1-CG2 4.31Å
131	R	59.6	Low	68.7	Low	215 Å²	215	55.8 Å²	55.8	81%	0.811	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-73.8	-17.4	173.9	-63.3	-177.2	179.2	-177.2	1.3	113.3	E129	E129-R131 PolarHBondContact O-N 3.44Å
132	E	62	Low	66.9	Low	67 Å²	67	59.2 Å²	59.2	31%	0.313	30%	0.295	S	S	.	.	S	Bend	trans	-70.4	126	176.3	-145.8	-152.4	138.4	0	0	109.5	R103 E129 V130 S134 I135 S136	R103-E132 IonicContact CZ-OE2 2.98Å; R103-E132 IonicContact NH1-OE2 3.3Å; R103-E132 PolarHBondContact NH1-OE2 2.87Å; R103-E132 IonicContact NH2-OE2 3.77Å; R103-E132 PolarHBondContact NH2-OE2 3.37Å; E129-E132 VanDerWaalsContact O-CB 3.26Å; E129-E132 WeakPolarHBondContact O-CB 3.09Å; E129-E132 PolarHBondContact O-N 3.05Å; V130-E132 VanDerWaalsContact C-N 3.29Å; E132-S134 PolarHBondContact O-N 3.1Å; E132-S134 WeakPolarHBondContact OE1-CB 3.43Å; E132-S134 PolarHBondContact OE1-OG 3.42Å; E132-I135 HydrophobicContact CB-CB 4.37Å; E132-I135 HydrophobicContact CB-CD1 4.15Å; E132-I135 HydrophobicContact CB-CG1 4.16Å; E132-I135 PolarHBondContact O-N 3.01Å; E132-I135 VanDerWaalsContact O-N 3.07Å; E132-S136 PolarHBondContact O-N 3.39Å
133	P	59.6	Low	65.2	Low	103 Å²	103	62.3 Å²	62.3	67%	0.669	31%	0.309	S	S	*	.	H	α-helix	trans	-57.1	-37.1	-178.1	-23.5	31.6	0	0	0	113	I135 S136 L137	P133-I135 VanDerWaalsContact C-N 3.33Å; P133-I135 PolarHBondContact O-N 3.5Å; P133-S136 PolarHBondContact O-N 3.46Å; P133-L137 WeakPolarHBondContact O-CB 3.37Å; P133-L137 PolarHBondContact O-N 3.18Å
134	S	60.4	Low	63.7	Low	63 Å²	63	69.8 Å²	69.8	44%	0.441	35%	0.347	S	S	.	.	H	α-helix	trans	-56.6	-46.2	176.9	-36.5	0	0	0	0	111.3	E132 L138	E132-S134 PolarHBondContact O-N 3.1Å; E132-S134 WeakPolarHBondContact OE1-CB 3.43Å; E132-S134 PolarHBondContact OE1-OG 3.42Å; S134-L138 WeakPolarHBondContact O-CB 3.4Å; S134-L138 PolarHBondContact O-N 3.25Å; S134-L138 VanDerWaalsContact O-N 3.12Å
135	I	59	Low	62.7	Low	0 Å²	0	74 Å²	74	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-78	-38.7	-179.6	-58.7	178.1	0	0	0	110.8	R103 Y125 E129 E132 P133 L137 L138 L139	R103-I135 VanDerWaalsContact CZ-CD1 3.45Å; Y125-I135 HydrophobicContact CD1-CD1 4.39Å; Y125-I135 HydrophobicContact CD1-CG2 4.32Å; Y125-I135 HydrophobicContact CE1-CD1 4.32Å; Y125-I135 HydrophobicContact CE1-CG2 4.24Å; E129-I135 HydrophobicContact CB-CD1 3.41Å; E129-I135 VanDerWaalsContact CB-CD1 3.41Å; E129-I135 HydrophobicContact CG-CD1 4.3Å; E129-I135 WeakPolarHBondContact O-CD1 3.49Å; E129-I135 WeakPolarHBondContact OE2-CD1 3.41Å; E132-I135 HydrophobicContact CB-CB 4.37Å; E132-I135 HydrophobicContact CB-CD1 4.15Å; E132-I135 HydrophobicContact CB-CG1 4.16Å; E132-I135 PolarHBondContact O-N 3.01Å; E132-I135 VanDerWaalsContact O-N 3.07Å; P133-I135 VanDerWaalsContact C-N 3.33Å; P133-I135 PolarHBondContact O-N 3.5Å; I135-L137 PolarHBondContact O-N 3.08Å; I135-L138 CarbonylContact O-C 3.58Å; I135-L138 WeakPolarHBondContact O-CB 3.3Å; I135-L138 PolarHBondContact O-N 3.39Å; I135-L138 VanDerWaalsContact O-N 3.11Å; I135-L139 HydrophobicContact CG2-CD1 3.65Å; I135-L139 HydrophobicContact CG2-CG 3.86Å; I135-L139 WeakPolarHBondContact O-CB 3.32Å; I135-L139 VanDerWaalsContact O-CG 3.24Å; I135-L139 WeakPolarHBondContact O-CG 3.4Å; I135-L139 PolarHBondContact O-N 3.46Å
136	S	60.5	Low	62.5	Low	26 Å²	26	75.3 Å²	75.3	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-57.7	-38.9	174.3	-170	0	0	0	0	111.8	E132 P133 K140	E132-S136 PolarHBondContact O-N 3.39Å; P133-S136 PolarHBondContact O-N 3.46Å; S136-K140 WeakPolarHBondContact O-CG 3.38Å; S136-K140 PolarHBondContact O-N 2.86Å; S136-K140 VanDerWaalsContact O-N 3.16Å
137	L	56.5	Low	62.5	Low	103 Å²	103	77.9 Å²	77.9	54%	0.539	39%	0.385	S	S	.	.	H	α-helix	trans	-68.9	-43.2	173.6	-166.7	75.1	0	0	0	112	P133 I135 L139 K140 F141	P133-L137 WeakPolarHBondContact O-CB 3.37Å; P133-L137 PolarHBondContact O-N 3.18Å; I135-L137 PolarHBondContact O-N 3.08Å; L137-L139 PolarHBondContact O-N 2.92Å; L137-K140 WeakPolarHBondContact O-CB 3.42Å; L137-K140 PolarHBondContact O-N 2.88Å; L137-F141 HydrophobicContact CD1-CE2 4.38Å; L137-F141 HydrophobicContact CG-CE2 4.39Å; L137-F141 WeakPolarHBondContact O-CD2 3.43Å; L137-F141 PolarHBondContact O-N 3.01Å
138	L	57.2	Low	63	Low	53 Å²	53	76.2 Å²	76.2	28%	0.277	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-41.2	175.4	-103.1	146	0	0	0	112.6	F107 S134 I135 K140 F141 F143	F107-L138 HydrophobicContact CE2-CD2 4.39Å; F107-L138 HydrophobicContact CZ-CD2 4.04Å; S134-L138 WeakPolarHBondContact O-CB 3.4Å; S134-L138 PolarHBondContact O-N 3.25Å; S134-L138 VanDerWaalsContact O-N 3.12Å; I135-L138 CarbonylContact O-C 3.58Å; I135-L138 WeakPolarHBondContact O-CB 3.3Å; I135-L138 PolarHBondContact O-N 3.39Å; I135-L138 VanDerWaalsContact O-N 3.11Å; L138-K140 VanDerWaalsContact C-N 3.31Å; L138-K140 PolarHBondContact O-N 2.85Å; L138-F141 CarbonylContact O-C 3.59Å; L138-F141 PolarHBondContact O-N 2.91Å; L138-F143 HydrophobicContact CD2-CE1 4.31Å; L138-F143 HydrophobicContact CD2-CE2 3.36Å; L138-F143 HydrophobicContact CD2-CZ 3.13Å
139	L	59.4	Low	63.8	Low	13 Å²	13	69.3 Å²	69.3	7%	0.068	35%	0.346	C	S	.	.	H	α-helix	trans	-75.1	-18.7	177.4	-62.4	170.8	0	0	0	112.8	Y125 V130 I135 L137 F141 T148 C163 V167	Y125-L139 HydrophobicContact CD2-CD2 4.24Å; Y125-L139 HydrophobicContact CE2-CD2 4.28Å; V130-L139 HydrophobicContact CB-CD1 4.45Å; V130-L139 HydrophobicContact CG1-CD1 3.96Å; V130-L139 HydrophobicContact CG2-CD1 4.05Å; I135-L139 HydrophobicContact CG2-CD1 3.65Å; I135-L139 HydrophobicContact CG2-CG 3.86Å; I135-L139 WeakPolarHBondContact O-CB 3.32Å; I135-L139 VanDerWaalsContact O-CG 3.24Å; I135-L139 WeakPolarHBondContact O-CG 3.4Å; I135-L139 PolarHBondContact O-N 3.46Å; L137-L139 PolarHBondContact O-N 2.92Å; L139-F141 VanDerWaalsContact C-N 3.33Å; L139-T148 HydrophobicContact CD2-CG2 4Å; L139-C163 HydrophobicContact CD2-CB 4.43Å; L139-C163 WeakPolarHBondContact CD2-SG 3.49Å; L139-V167 HydrophobicContact CB-CG2 4Å
140	K	54.7	Low	64.7	Low	114 Å²	114	67.4 Å²	67.4	50%	0.496	34%	0.337	S	S	.	.	H	α-helix	trans	-72	-26.4	171.6	-83.5	175.1	-179.3	179.4	0	112.8	S136 L137 L138 P142	S136-K140 WeakPolarHBondContact O-CG 3.38Å; S136-K140 PolarHBondContact O-N 2.86Å; S136-K140 VanDerWaalsContact O-N 3.16Å; L137-K140 WeakPolarHBondContact O-CB 3.42Å; L137-K140 PolarHBondContact O-N 2.88Å; L138-K140 VanDerWaalsContact C-N 3.31Å; L138-K140 PolarHBondContact O-N 2.85Å; K140-P142 VanDerWaalsContact O-CD 3.25Å; K140-P142 WeakPolarHBondContact O-CD 3.42Å
141	F	57.2	Low	65.9	Low	148 Å²	148	67 Å²	67	65%	0.649	33%	0.334	S	S	*	.	S	Bend	trans	-102.3	91.8	172.8	-67.1	-76.9	0	0	0	107.9	L137 L138 L139 F143	L137-F141 HydrophobicContact CD1-CE2 4.38Å; L137-F141 HydrophobicContact CG-CE2 4.39Å; L137-F141 WeakPolarHBondContact O-CD2 3.43Å; L137-F141 PolarHBondContact O-N 3.01Å; L138-F141 CarbonylContact O-C 3.59Å; L138-F141 PolarHBondContact O-N 2.91Å; L139-F141 VanDerWaalsContact C-N 3.33Å; F141-F143 PolarHBondContact O-N 3.28Å
142	P	50.8	Low	67.1	Low	74 Å²	74	57.7 Å²	57.7	48%	0.481	30%	0.303	S	S	.	.			trans	-54.5	120.6	176.5	22.6	-31.7	0	0	0	108.1	K140 I144	K140-P142 VanDerWaalsContact O-CD 3.25Å; K140-P142 WeakPolarHBondContact O-CD 3.42Å; P142-I144 VanDerWaalsContact C-N 3.26Å; P142-I144 PolarHBondContact O-N 3.06Å
143	F	55.5	Low	68	Low	65 Å²	65	58 Å²	58	29%	0.285	31%	0.307	S	S	.	.			trans	-62.7	97.2	165.8	-67.6	-78.6	0	0	0	106.5	F107 L138 F141 N145 Y146	F107-F143 HydrophobicContact CD1-CZ 4.4Å; F107-F143 AromaticContact CE1-CE1 3.9Å; F107-F143 HydrophobicContact CE1-CE1 3.9Å; F107-F143 AromaticContact CE1-CE2 3.84Å; F107-F143 HydrophobicContact CE1-CE2 3.84Å; F107-F143 AromaticContact CE1-CZ 3.37Å; F107-F143 HydrophobicContact CE1-CZ 3.37Å; F107-F143 HydrophobicContact CE2-CZ 4.45Å; F107-F143 HydrophobicContact CZ-CE1 4.33Å; F107-F143 AromaticContact CZ-CE2 3.77Å; F107-F143 HydrophobicContact CZ-CE2 3.77Å; F107-F143 AromaticContact CZ-CZ 3.41Å; F107-F143 HydrophobicContact CZ-CZ 3.41Å; F107-F143 VanDerWaalsContact CZ-CZ 3.41Å; L138-F143 HydrophobicContact CD2-CE1 4.31Å; L138-F143 HydrophobicContact CD2-CE2 3.36Å; L138-F143 HydrophobicContact CD2-CZ 3.13Å; F141-F143 PolarHBondContact O-N 3.28Å; F143-N145 PolarHBondContact O-N 2.9Å; F143-Y146 HydrophobicContact CB-CD2 3.5Å; F143-Y146 VanDerWaalsContact CB-CD2 3.5Å; F143-Y146 HydrophobicContact CB-CE2 4.29Å; F143-Y146 HydrophobicContact CB-CG 4.12Å; F143-Y146 AromaticContact CD1-CD2 3.98Å; F143-Y146 HydrophobicContact CD1-CD2 3.98Å; F143-Y146 HydrophobicContact CD1-CE2 4.04Å; F143-Y146 HydrophobicContact CD2-CD2 4.4Å; F143-Y146 AromaticContact CG-CD2 3.74Å; F143-Y146 HydrophobicContact CG-CD2 3.74Å; F143-Y146 HydrophobicContact CG-CE2 4.29Å; F143-Y146 PolarHBondContact O-N 3.05Å
144	I	57.2	Low	68.8	Low	158 Å²	158	56.8 Å²	56.8	81%	0.81	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.5	-171.3	-65.1	169.8	0	0	0	111.5	P142	P142-I144 VanDerWaalsContact C-N 3.26Å; P142-I144 PolarHBondContact O-N 3.06Å
145	N	69.1	Low	69.4	Low	89 Å²	89	60.6 Å²	60.6	48%	0.476	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-1.7	-173.9	-60.7	-16.5	0	0	0	114.9	E114 F143	E114-N145 PolarHBondContact OE1-ND2 2.76Å; F143-N145 PolarHBondContact O-N 2.9Å
146	Y	79.9	Confident	70.1	Confident	28 Å²	28	63.7 Å²	63.7	11%	0.11	34%	0.338	C	S	.	.	S	Bend	trans	-120.9	139.2	-178.9	-52.7	-40.2	0	0	0	112.1	L110 E114 N121 V123 F143 T148	L110-Y146 HydrophobicContact CB-CE1 4.46Å; E114-Y146 PolarHBondContact OE2-OH 2.86Å; N121-Y146 HydrophobicContact CB-CD1 3.86Å; N121-Y146 HydrophobicContact CB-CE1 4.34Å; V123-Y146 HydrophobicContact CG2-CG 4.41Å; F143-Y146 HydrophobicContact CB-CD2 3.5Å; F143-Y146 VanDerWaalsContact CB-CD2 3.5Å; F143-Y146 HydrophobicContact CB-CE2 4.29Å; F143-Y146 HydrophobicContact CB-CG 4.12Å; F143-Y146 AromaticContact CD1-CD2 3.98Å; F143-Y146 HydrophobicContact CD1-CD2 3.98Å; F143-Y146 HydrophobicContact CD1-CE2 4.04Å; F143-Y146 HydrophobicContact CD2-CD2 4.4Å; F143-Y146 AromaticContact CG-CD2 3.74Å; F143-Y146 HydrophobicContact CG-CD2 3.74Å; F143-Y146 HydrophobicContact CG-CE2 4.29Å; F143-Y146 PolarHBondContact O-N 3.05Å; Y146-T148 PolarHBondContact O-N 2.99Å
147	K	83.8	Confident	71	Confident	67 Å²	67	68.7 Å²	68.7	29%	0.291	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	99.9	174.7	-171	61.4	164.3	177	0	109.9	N121 V122 V123 D162 F195	N121-K147 PolarHBondContact O-N 2.76Å; V122-K147 CarbonylContact C-O 3.53Å; V122-K147 WeakPolarHBondContact CA-O 3.48Å; V122-K147 HydrophobicContact CG2-CB 4.33Å; V123-K147 PolarHBondContact N-O 2.8Å; K147-D162 IonicContact NZ-OD2 2.66Å; K147-D162 PolarHBondContact NZ-OD2 3.43Å; K147-F195 HydrophobicContact CB-CE2 4.16Å; K147-F195 HydrophobicContact CG-CD2 4.22Å; K147-F195 HydrophobicContact CG-CE2 4.2Å
148	T	84.2	Confident	72.4	Confident	14 Å²	14	64 Å²	64	9%	0.086	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.2	180	-47.8	0	0	0	0	112.5	V123 Y125 L139 Y146 C163	V123-T148 HydrophobicContact CG1-CG2 4.46Å; V123-T148 CarbonylContact O-C 3.58Å; V123-T148 WeakPolarHBondContact O-CA 3.28Å; Y125-T148 HydrophobicContact CD2-CG2 3.82Å; Y125-T148 HydrophobicContact CE2-CG2 4.07Å; L139-T148 HydrophobicContact CD2-CG2 4Å; Y146-T148 PolarHBondContact O-N 2.99Å; T148-C163 HydrophobicContact CG2-CB 3.88Å; T148-C163 PolarHBondContact O-N 2.73Å
149	L	86.4	Confident	73.7	Confident	6 Å²	6	62 Å²	62	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.7	175.7	-60.4	176.8	0	0	0	111	V122 V123 L124 Y125 F161 K191 M192	V122-L149 HydrophobicContact CG1-CD1 3.83Å; V122-L149 HydrophobicContact CG1-CG 4.2Å; V123-L149 PolarHBondContact O-N 2.79Å; L124-L149 WeakPolarHBondContact CA-O 3.39Å; L124-L149 HydrophobicContact CD2-CB 3.83Å; L124-L149 HydrophobicContact CD2-CD1 4.08Å; L124-L149 HydrophobicContact CD2-CG 4.43Å; Y125-L149 PolarHBondContact N-O 2.86Å; L149-F161 WeakPolarHBondContact CA-O 3.27Å; L149-K191 HydrophobicContact CD2-CG 4.17Å; L149-M192 HydrophobicContact CD1-CE 4.13Å
150	L	84.7	Confident	74.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.5	170.3	-72.1	161.1	0	0	0	109.2	Y125 M127 V130 A160 F161 V166	Y125-L150 CarbonylContact O-C 3.5Å; Y125-L150 WeakPolarHBondContact O-CA 3.35Å; M127-L150 HydrophobicContact CE-CB 3.95Å; M127-L150 HydrophobicContact CE-CD1 4.17Å; M127-L150 HydrophobicContact CG-CB 4.36Å; M127-L150 HydrophobicContact SD-CB 4.15Å; M127-L150 HydrophobicContact SD-CD1 4.24Å; M127-L150 HydrophobicContact SD-CD2 4.43Å; V130-L150 HydrophobicContact CG2-CD1 4.34Å; V130-L150 HydrophobicContact CG2-CD2 3.3Å; V130-L150 HydrophobicContact CG2-CG 4.46Å; L150-A160 CarbonylContact O-C 3.57Å; L150-A160 VanDerWaalsContact O-CA 3.31Å; L150-A160 WeakPolarHBondContact O-CA 3.43Å; L150-F161 HydrophobicContact CB-CB 4.3Å; L150-F161 PolarHBondContact N-O 2.74Å; L150-F161 PolarHBondContact O-N 3.32Å; L150-V166 HydrophobicContact CD1-CB 4.15Å; L150-V166 HydrophobicContact CD1-CG1 4.11Å; L150-V166 HydrophobicContact CD1-CG2 4.48Å
151	Y	87	Confident	76	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.2	178.9	66.2	-87.7	0	0	0	112.4	L49 V53 D96 S98 L124 Y125 T126 M127 L158 V159	L49-Y151 HydrophobicContact CB-CE2 4.17Å; L49-Y151 HydrophobicContact CD2-CD2 3.77Å; L49-Y151 HydrophobicContact CD2-CE2 3.94Å; V53-Y151 HydrophobicContact CG2-CD1 4.37Å; V53-Y151 HydrophobicContact CG2-CD2 3.45Å; V53-Y151 VanDerWaalsContact CG2-CD2 3.45Å; V53-Y151 HydrophobicContact CG2-CE1 4.46Å; V53-Y151 HydrophobicContact CG2-CE2 3.57Å; V53-Y151 HydrophobicContact CG2-CG 3.88Å; D96-Y151 WeakPolarHBondContact OD1-CE1 3.45Å; D96-Y151 PolarHBondContact OD1-OH 3.36Å; D96-Y151 PolarHBondContact OD2-OH 2.91Å; S98-Y151 PolarHBondContact OG-OH 2.78Å; L124-Y151 HydrophobicContact CB-CD1 3.92Å; L124-Y151 HydrophobicContact CB-CE1 3.67Å; Y125-Y151 WeakPolarHBondContact O-CD1 3.38Å; Y125-Y151 WeakPolarHBondContact O-CE1 3.28Å; Y125-Y151 PolarHBondContact O-N 2.89Å; T126-Y151 HydrophobicContact CG2-CE2 4.08Å; M127-Y151 PolarHBondContact N-O 3.48Å; Y151-L158 HydrophobicContact CD2-CD1 4.12Å; Y151-V159 WeakPolarHBondContact CA-O 3.43Å
152	A	83.9	Confident	76.8	Confident	20 Å²	20	50.8 Å²	50.8	17%	0.165	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	156.9	177.8	0	0	0	0	0	110.8	M127 V159	M127-A152 HydrophobicContact CB-CB 3.89Å; M127-A152 HydrophobicContact CG-CB 3.8Å; A152-V159 HydrophobicContact CB-CG2 4.31Å; A152-V159 PolarHBondContact N-O 2.66Å; A152-V159 VanDerWaalsContact N-O 3.08Å; A152-V159 VanDerWaalsContact O-CG2 3.25Å; A152-V159 WeakPolarHBondContact O-CG2 3.49Å; A152-V159 PolarHBondContact O-N 3.04Å
153	L	80.9	Confident	77.7	Confident	75 Å²	75	47.5 Å²	47.5	39%	0.393	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.3	165.8	-95.8	159.5	0	0	0	108.6	L49	L49-L153 HydrophobicContact CD1-CB 4.49Å; L49-L153 HydrophobicContact CD1-CD1 3.91Å; L49-L153 HydrophobicContact CG-CB 4.49Å; L49-L153 HydrophobicContact CG-CD1 3.78Å; L49-L153 HydrophobicContact CG-CG 4.2Å
154	K	76.7	Confident	78.1	Confident	76 Å²	76	49.5 Å²	49.5	33%	0.33	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.1	172.2	-171.1	-173	-179.4	-171.2	0	108.2	G156 H157 V159 P182	K154-G156 PolarHBondContact O-N 3.12Å; K154-G156 VanDerWaalsContact O-N 3.16Å; K154-H157 PolarHBondContact N-O 3.25Å; K154-H157 PolarHBondContact O-N 3.17Å; K154-V159 HydrophobicContact CB-CG1 4.3Å; K154-V159 HydrophobicContact CB-CG2 3.74Å; K154-P182 HydrophobicContact CD-CG 4.12Å; K154-P182 PolarHBondContact NZ-O 3.01Å
155	D	73.8	Confident	78.3	Confident	144 Å²	144	48.2 Å²	48.2	77%	0.77	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	37.1	-179.9	-52.7	-44	0	0	0	113.4	H157	D155-H157 VanDerWaalsContact C-N 3.28Å; D155-H157 PolarHBondContact O-N 3.01Å
156	G	73.6	Confident	77.7	Confident	64 Å²	64	44.9 Å²	44.9	66%	0.66	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.4	-4.1	-178.4	0	0	0	0	0	115.7	K154	K154-G156 PolarHBondContact O-N 3.12Å; K154-G156 VanDerWaalsContact O-N 3.16Å
157	H	79.6	Confident	76.6	Confident	131 Å²	131	45 Å²	45	61%	0.606	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	140.4	177.8	-63.9	-69.4	0	0	0	112	K154 D155 V159	K154-H157 PolarHBondContact N-O 3.25Å; K154-H157 PolarHBondContact O-N 3.17Å; D155-H157 VanDerWaalsContact C-N 3.28Å; D155-H157 PolarHBondContact O-N 3.01Å; H157-V159 PolarHBondContact O-N 3.35Å
158	L	84.5	Confident	75.1	Confident	5 Å²	5	46 Å²	46	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.4	175.3	-171.9	71.9	0	0	0	109.7	V53 E56 Y151 F188	V53-L158 HydrophobicContact CB-CD2 4.24Å; V53-L158 HydrophobicContact CG2-CD1 3.99Å; V53-L158 HydrophobicContact CG2-CD2 3.76Å; E56-L158 HydrophobicContact CB-CD2 4.36Å; E56-L158 HydrophobicContact CG-CD2 4.13Å; E56-L158 WeakPolarHBondContact OE1-CB 3.02Å; Y151-L158 HydrophobicContact CD2-CD1 4.12Å; L158-F188 HydrophobicContact CB-CB 4.42Å; L158-F188 HydrophobicContact CD2-CB 3.65Å; L158-F188 HydrophobicContact CD2-CD1 3.99Å; L158-F188 HydrophobicContact CD2-CD2 4.15Å; L158-F188 HydrophobicContact CD2-CG 3.67Å; L158-F188 HydrophobicContact CG-CB 3.81Å; L158-F188 HydrophobicContact CG-CG 4.3Å; L158-F188 PolarHBondContact O-N 2.97Å; L158-F188 VanDerWaalsContact O-N 3.09Å
159	V	84.8	Confident	73.4	Confident	12 Å²	12	50.4 Å²	50.4	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	140.1	177.2	-70.8	0	0	0	0	110	Y151 A152 K154 H157 F161	Y151-V159 WeakPolarHBondContact CA-O 3.43Å; A152-V159 HydrophobicContact CB-CG2 4.31Å; A152-V159 PolarHBondContact N-O 2.66Å; A152-V159 VanDerWaalsContact N-O 3.08Å; A152-V159 VanDerWaalsContact O-CG2 3.25Å; A152-V159 WeakPolarHBondContact O-CG2 3.49Å; A152-V159 PolarHBondContact O-N 3.04Å; K154-V159 HydrophobicContact CB-CG1 4.3Å; K154-V159 HydrophobicContact CB-CG2 3.74Å; H157-V159 PolarHBondContact O-N 3.35Å; V159-F161 HydrophobicContact CB-CE2 4.12Å; V159-F161 HydrophobicContact CB-CZ 4.2Å; V159-F161 HydrophobicContact CG2-CE2 3.59Å; V159-F161 HydrophobicContact CG2-CZ 3.81Å
160	A	83.1	Confident	71.6	Confident	2 Å²	2	51.4 Å²	51.4	2%	0.017	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.1	176	0	0	0	0	0	111.1	L150 C186 F188	L150-A160 CarbonylContact O-C 3.57Å; L150-A160 VanDerWaalsContact O-CA 3.31Å; L150-A160 WeakPolarHBondContact O-CA 3.43Å; A160-C186 PolarHBondContact N-O 3.29Å; A160-F188 HydrophobicContact CB-CB 3.88Å; A160-F188 HydrophobicContact CB-CD2 3.81Å; A160-F188 HydrophobicContact CB-CG 4.26Å
161	F	78.8	Confident	69.8	Low	24 Å²	24	54.3 Å²	54.3	11%	0.105	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140	177.7	-51.1	-92	0	0	0	110.2	M127 L149 L150 V159 V166 P182	M127-F161 HydrophobicContact CE-CB 4.03Å; M127-F161 HydrophobicContact CE-CD2 3.25Å; M127-F161 HydrophobicContact CE-CE2 3.75Å; M127-F161 HydrophobicContact CE-CG 3.69Å; L149-F161 WeakPolarHBondContact CA-O 3.27Å; L150-F161 HydrophobicContact CB-CB 4.3Å; L150-F161 PolarHBondContact N-O 2.74Å; L150-F161 PolarHBondContact O-N 3.32Å; V159-F161 HydrophobicContact CB-CE2 4.12Å; V159-F161 HydrophobicContact CB-CZ 4.2Å; V159-F161 HydrophobicContact CG2-CE2 3.59Å; V159-F161 HydrophobicContact CG2-CZ 3.81Å; F161-V166 HydrophobicContact CB-CG2 3.47Å; F161-V166 VanDerWaalsContact CB-CG2 3.47Å; F161-V166 HydrophobicContact CD1-CG2 4.37Å; F161-V166 HydrophobicContact CG-CG2 4.17Å; F161-P182 HydrophobicContact CE1-CB 3.84Å; F161-P182 HydrophobicContact CZ-CB 3.77Å; F161-P182 HydrophobicContact CZ-CG 4.49Å
162	D	74.9	Confident	67.9	Low	12 Å²	12	56.4 Å²	56.4	6%	0.064	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.8	173.1	-163.5	-40.5	0	0	0	108.8	K147 N164 Q165 V166 K191	K147-D162 IonicContact NZ-OD2 2.66Å; K147-D162 PolarHBondContact NZ-OD2 3.43Å; D162-N164 PolarHBondContact O-N 3.04Å; D162-N164 PolarHBondContact OD1-N 3.04Å; D162-N164 VanDerWaalsContact OD1-N 3.17Å; D162-Q165 HydrophobicContact CB-CB 4.34Å; D162-Q165 HydrophobicContact CB-CG 4.05Å; D162-Q165 WeakPolarHBondContact O-CB 3.32Å; D162-Q165 PolarHBondContact O-N 3.2Å; D162-V166 PolarHBondContact O-N 3.17Å; D162-K191 IonicContact OD2-NZ 3.96Å
163	C	68.8	Low	66.1	Low	5 Å²	5	57 Å²	57	3%	0.034	33%	0.327	C	S	.	.	H	α-helix	trans	-53.4	-40.1	179.4	-176	0	0	0	0	111.7	L139 T148 Q165 V166 V167	L139-C163 HydrophobicContact CD2-CB 4.43Å; L139-C163 WeakPolarHBondContact CD2-SG 3.49Å; T148-C163 HydrophobicContact CG2-CB 3.88Å; T148-C163 PolarHBondContact O-N 2.73Å; C163-Q165 PolarHBondContact O-N 3.35Å; C163-Q165 VanDerWaalsContact O-N 3.13Å; C163-V166 PolarHBondContact O-N 3.44Å; C163-V166 VanDerWaalsContact O-N 3.08Å; C163-V167 WeakPolarHBondContact O-CG2 3.41Å; C163-V167 PolarHBondContact O-N 3.48Å; C163-V167 WeakPolarHBondContact SG-CG2 3.34Å
164	N	63.6	Low	64.3	Low	108 Å²	108	58.7 Å²	58.7	58%	0.578	34%	0.336	S	S	*	.	H	α-helix	trans	-63.3	-21.8	179.2	-69	-18.9	0	0	0	113.4	D162	D162-N164 PolarHBondContact O-N 3.04Å; D162-N164 PolarHBondContact OD1-N 3.04Å; D162-N164 VanDerWaalsContact OD1-N 3.17Å
165	Q	61.5	Low	62.8	Low	130 Å²	130	63.3 Å²	63.3	61%	0.607	36%	0.359	S	S	*	.	H	α-helix	trans	-90.9	-24.5	176.9	-66	-178.2	-14.9	0	0	112.8	D162 C163	D162-Q165 HydrophobicContact CB-CB 4.34Å; D162-Q165 HydrophobicContact CB-CG 4.05Å; D162-Q165 WeakPolarHBondContact O-CB 3.32Å; D162-Q165 PolarHBondContact O-N 3.2Å; C163-Q165 PolarHBondContact O-N 3.35Å; C163-Q165 VanDerWaalsContact O-N 3.13Å
166	V	57.4	Low	61.4	Low	19 Å²	19	59.8 Å²	59.8	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-98.7	-38.4	-169.9	176.4	0	0	0	0	113	M127 L150 F161 D162 C163 P168 N169 I170	M127-V166 HydrophobicContact CE-CG1 4.13Å; M127-V166 HydrophobicContact CE-CG2 4.41Å; L150-V166 HydrophobicContact CD1-CB 4.15Å; L150-V166 HydrophobicContact CD1-CG1 4.11Å; L150-V166 HydrophobicContact CD1-CG2 4.48Å; F161-V166 HydrophobicContact CB-CG2 3.47Å; F161-V166 VanDerWaalsContact CB-CG2 3.47Å; F161-V166 HydrophobicContact CD1-CG2 4.37Å; F161-V166 HydrophobicContact CG-CG2 4.17Å; D162-V166 PolarHBondContact O-N 3.17Å; C163-V166 PolarHBondContact O-N 3.44Å; C163-V166 VanDerWaalsContact O-N 3.08Å; V166-P168 VanDerWaalsContact C-CD 3.41Å; V166-N169 PolarHBondContact O-N 3.01Å; V166-I170 HydrophobicContact CG1-CD1 3.29Å; V166-I170 HydrophobicContact CG1-CG1 3.68Å; V166-I170 PolarHBondContact O-N 3.33Å
167	V	56.3	Low	59.6	Low	30 Å²	30	60.6 Å²	60.6	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-57.2	-38.4	-176.6	176.1	0	0	0	0	113.6	L139 C163 N169 I170 V171	L139-V167 HydrophobicContact CB-CG2 4Å; C163-V167 WeakPolarHBondContact O-CG2 3.41Å; C163-V167 PolarHBondContact O-N 3.48Å; C163-V167 WeakPolarHBondContact SG-CG2 3.34Å; V167-N169 PolarHBondContact O-N 3.46Å; V167-I170 PolarHBondContact O-N 2.92Å; V167-V171 HydrophobicContact CG1-CG2 4.2Å; V167-V171 WeakPolarHBondContact O-CG2 3.33Å; V167-V171 PolarHBondContact O-N 2.72Å
168	P	53.2	Low	57.1	Low	89 Å²	89	61.1 Å²	61.1	58%	0.578	36%	0.358	S	S	*	.	H	α-helix	trans	-58.6	-34.1	174.9	-22.9	33.1	0	0	0	113.1	V166	V166-P168 VanDerWaalsContact C-CD 3.41Å
169	N	47.7	Very low	54.8	Low	106 Å²	106	66.4 Å²	66.4	57%	0.567	40%	0.395	S	S	*	.	H	α-helix	trans	-85	-36.7	-177.3	-71.8	-21.6	0	0	0	112.7	V166 V167 G172 T173	V166-N169 PolarHBondContact O-N 3.01Å; V167-N169 PolarHBondContact O-N 3.46Å; N169-G172 PolarHBondContact O-N 3.14Å; N169-T173 PolarHBondContact O-N 2.78Å; N169-T173 VanDerWaalsContact O-N 3.16Å; N169-T173 PolarHBondContact O-OG1 3.02Å
170	I	48.8	Very low	52.8	Low	28 Å²	28	69.9 Å²	69.9	14%	0.144	42%	0.416	C	S	.	.	H	α-helix	trans	-67.9	-38.2	179.6	-67.7	-176.7	0	0	0	111.5	V130 V166 V167 G172 T173 L174	V130-I170 HydrophobicContact CG1-CD1 3.72Å; V130-I170 HydrophobicContact CG1-CG2 4.31Å; V166-I170 HydrophobicContact CG1-CD1 3.29Å; V166-I170 HydrophobicContact CG1-CG1 3.68Å; V166-I170 PolarHBondContact O-N 3.33Å; V167-I170 PolarHBondContact O-N 2.92Å; I170-G172 VanDerWaalsContact C-N 3.3Å; I170-G172 PolarHBondContact O-N 3.03Å; I170-T173 PolarHBondContact O-N 3.09Å; I170-T173 VanDerWaalsContact O-N 3.16Å; I170-L174 HydrophobicContact CG2-CD1 3.64Å; I170-L174 HydrophobicContact CG2-CG 4.05Å; I170-L174 WeakPolarHBondContact O-CG 3.11Å; I170-L174 PolarHBondContact O-N 3.24Å
171	V	48.2	Very low	50.7	Low	61 Å²	61	73.4 Å²	73.4	37%	0.37	44%	0.441	S	S	.	.	H	α-helix	trans	-65.1	-34.1	178.6	178.3	0	0	0	0	111.7	V167	V167-V171 HydrophobicContact CG1-CG2 4.2Å; V167-V171 WeakPolarHBondContact O-CG2 3.33Å; V167-V171 PolarHBondContact O-N 2.72Å
172	G	46.7	Very low	49.2	Very low	44 Å²	44	74.5 Å²	74.5	45%	0.454	45%	0.451	S	S	.	.	H	α-helix	trans	-73.2	-29	173.6	0	0	0	0	0	114	N169 I170 S176	N169-G172 PolarHBondContact O-N 3.14Å; I170-G172 VanDerWaalsContact C-N 3.3Å; I170-G172 PolarHBondContact O-N 3.03Å; G172-S176 PolarHBondContact O-OG 3.19Å
173	T	45	Very low	47.8	Very low	31 Å²	31	82.1 Å²	82.1	19%	0.19	49%	0.486	C	S	.	.	H	α-helix	trans	-92.4	-29	-172.8	-36.1	0	0	0	0	113.2	N169 I170 Q175 S176 G177 M178 V180	N169-T173 PolarHBondContact O-N 2.78Å; N169-T173 VanDerWaalsContact O-N 3.16Å; N169-T173 PolarHBondContact O-OG1 3.02Å; I170-T173 PolarHBondContact O-N 3.09Å; I170-T173 VanDerWaalsContact O-N 3.16Å; T173-Q175 PolarHBondContact O-N 3.47Å; T173-Q175 VanDerWaalsContact O-N 3.17Å; T173-S176 PolarHBondContact O-N 3.15Å; T173-G177 PolarHBondContact O-N 3.13Å; T173-M178 HydrophobicContact CG2-CB 3.95Å; T173-M178 WeakPolarHBondContact CG2-O 3.21Å; T173-V180 HydrophobicContact CG2-CG2 3.92Å
174	L	43.7	Very low	47	Very low	112 Å²	112	88.3 Å²	88.3	59%	0.586	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19	171.4	-78.4	168.1	0	0	0	112.7	I170	I170-L174 HydrophobicContact CG2-CD1 3.64Å; I170-L174 HydrophobicContact CG2-CG 4.05Å; I170-L174 WeakPolarHBondContact O-CG 3.11Å; I170-L174 PolarHBondContact O-N 3.24Å
175	Q	45.6	Very low	46.5	Very low	173 Å²	173	84.7 Å²	84.7	81%	0.808	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-16	173.1	-69.7	-175.1	-13.3	0	0	114	T173	T173-Q175 PolarHBondContact O-N 3.47Å; T173-Q175 VanDerWaalsContact O-N 3.17Å
176	S	44.2	Very low	46.9	Very low	69 Å²	69	81 Å²	81	48%	0.483	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	6.2	-169.3	61.3	0	0	0	0	116.1	G172 T173 M178	G172-S176 PolarHBondContact O-OG 3.19Å; T173-S176 PolarHBondContact O-N 3.15Å; S176-M178 PolarHBondContact O-N 3.24Å
177	G	34.5	Very low	48	Very low	81 Å²	81	82.9 Å²	82.9	84%	0.835	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	12.2	170	0	0	0	0	0	115.5	T173	T173-G177 PolarHBondContact O-N 3.13Å
178	M	28.9	Very low	49.4	Very low	142 Å²	142	81.5 Å²	81.5	70%	0.7	50%	0.503	S	S	*	.			trans	-84.7	140.6	178.4	-63.7	-164.5	74.6	0	0	111.4	T173 S176 V180	T173-M178 HydrophobicContact CG2-CB 3.95Å; T173-M178 WeakPolarHBondContact CG2-O 3.21Å; S176-M178 PolarHBondContact O-N 3.24Å; M178-V180 PolarHBondContact O-N 3.4Å
179	S	35.8	Very low	50.9	Low	116 Å²	116	79.1 Å²	79.1	81%	0.811	49%	0.488	S	S	*	.			trans	-68.9	120.6	172.8	60.5	0	0	0	0	110.4	S181	S179-S181 PolarHBondContact O-N 3.35Å
180	V	41.9	Very low	52.5	Low	85 Å²	85	77.4 Å²	77.4	52%	0.515	48%	0.484	S	S	.	.			trans	-64.9	103.8	171.9	179.1	0	0	0	0	108.8	T173 M178 P182	T173-V180 HydrophobicContact CG2-CG2 3.92Å; M178-V180 PolarHBondContact O-N 3.4Å; V180-P182 WeakPolarHBondContact O-CD 3.32Å
181	S	39.3	Very low	54.2	Low	76 Å²	76	78 Å²	78	53%	0.531	49%	0.486	S	S	.	.			trans	-74.5	116	164.6	63.1	0	0	0	0	108.2	S179 Q183	S179-S181 PolarHBondContact O-N 3.35Å; S181-Q183 PolarHBondContact O-N 2.95Å
182	P	46.5	Very low	56.1	Low	48 Å²	48	75.3 Å²	75.3	31%	0.312	47%	0.469	S	S	.	.			trans	-74.6	97.3	179.4	1.2	14.1	0	0	0	107.8	K154 F161 V180 T184	K154-P182 HydrophobicContact CD-CG 4.12Å; K154-P182 PolarHBondContact NZ-O 3.01Å; F161-P182 HydrophobicContact CE1-CB 3.84Å; F161-P182 HydrophobicContact CZ-CB 3.77Å; F161-P182 HydrophobicContact CZ-CG 4.49Å; V180-P182 WeakPolarHBondContact O-CD 3.32Å; P182-T184 VanDerWaalsContact C-N 3.34Å; P182-T184 PolarHBondContact O-N 3.41Å
183	Q	45.6	Very low	57.8	Low	172 Å²	172	77.1 Å²	77.1	80%	0.804	47%	0.465	S	S	*	.	S	Bend	trans	-78.6	-9.9	-173.1	-74	-162.7	-10.3	0	0	114.6	S181	S181-Q183 PolarHBondContact O-N 2.95Å
184	T	52.4	Low	59.6	Low	134 Å²	134	81.9 Å²	81.9	82%	0.822	48%	0.483	S	S	*	.			trans	-156.7	77	172.5	47.7	0	0	0	0	111.5	P182	P182-T184 VanDerWaalsContact C-N 3.34Å; P182-T184 PolarHBondContact O-N 3.41Å
185	G	54.2	Low	61.6	Low	33 Å²	33	77.9 Å²	77.9	34%	0.34	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-86	124.1	165.2	0	0	0	0	0	109.7
186	C	69	Low	63.4	Low	51 Å²	51	69.7 Å²	69.7	35%	0.345	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	153.1	164.2	56.7	0	0	0	0	109.6	A160	A160-C186 PolarHBondContact N-O 3.29Å
187	T	81.4	Confident	65	Low	60 Å²	60	72 Å²	72	37%	0.368	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	143.6	172.6	61.6	0	0	0	0	109.9	C189 S190 K191	T187-C189 PolarHBondContact O-N 3.1Å; T187-S190 PolarHBondContact O-N 3.36Å; T187-S190 VanDerWaalsContact O-N 3.08Å; T187-S190 WeakPolarHBondContact OG1-CB 3.45Å; T187-S190 PolarHBondContact OG1-N 2.96Å; T187-S190 PolarHBondContact OG1-OG 3.4Å; T187-K191 PolarHBondContact O-N 3.47Å
188	F	86	Confident	67	Low	1 Å²	1	72.6 Å²	72.6	0%	0.004	41%	0.405	C	S	.	.	H	α-helix	trans	-53.8	-45.2	179.7	170.4	-80.1	0	0	0	111.2	V53 E56 I57 L124 L158 A160 S190 K191 M192	V53-F188 HydrophobicContact CG1-CE1 4.39Å; V53-F188 HydrophobicContact CG1-CE2 4.04Å; V53-F188 HydrophobicContact CG1-CZ 3.8Å; E56-F188 HydrophobicContact CB-CD1 3.87Å; E56-F188 HydrophobicContact CB-CE1 4.26Å; E56-F188 VanDerWaalsContact OE2-CB 3.3Å; E56-F188 WeakPolarHBondContact OE2-CB 3.39Å; E56-F188 WeakPolarHBondContact OE2-CD1 3.49Å; I57-F188 HydrophobicContact CD1-CE1 4.32Å; I57-F188 HydrophobicContact CD1-CZ 4.01Å; I57-F188 HydrophobicContact CG1-CE1 3.59Å; I57-F188 HydrophobicContact CG1-CZ 3.78Å; L124-F188 HydrophobicContact CD1-CE2 4.39Å; L124-F188 HydrophobicContact CD2-CE2 4.1Å; L158-F188 HydrophobicContact CB-CB 4.42Å; L158-F188 HydrophobicContact CD2-CB 3.65Å; L158-F188 HydrophobicContact CD2-CD1 3.99Å; L158-F188 HydrophobicContact CD2-CD2 4.15Å; L158-F188 HydrophobicContact CD2-CG 3.67Å; L158-F188 HydrophobicContact CG-CB 3.81Å; L158-F188 HydrophobicContact CG-CG 4.3Å; L158-F188 PolarHBondContact O-N 2.97Å; L158-F188 VanDerWaalsContact O-N 3.09Å; A160-F188 HydrophobicContact CB-CB 3.88Å; A160-F188 HydrophobicContact CB-CD2 3.81Å; A160-F188 HydrophobicContact CB-CG 4.26Å; F188-S190 PolarHBondContact O-N 3.38Å; F188-K191 PolarHBondContact O-N 3.42Å; F188-M192 HydrophobicContact CE1-CB 4.42Å; F188-M192 HydrophobicContact CE1-CE 4.24Å; F188-M192 HydrophobicContact CE2-CE 4.21Å; F188-M192 HydrophobicContact CZ-CE 3.61Å; F188-M192 PolarHBondContact O-N 3.36Å
189	C	83.4	Confident	69.3	Low	39 Å²	39	66 Å²	66	26%	0.264	37%	0.373	S	S	.	.	H	α-helix	trans	-53	-45.1	174.6	-165.7	0	0	0	0	113.9	E56 T187 K191 M192 K193	E56-C189 WeakPolarHBondContact OE2-CB 3.48Å; E56-C189 PolarHBondContact OE2-N 3.21Å; T187-C189 PolarHBondContact O-N 3.1Å; C189-K191 PolarHBondContact O-N 2.91Å; C189-M192 PolarHBondContact O-N 2.93Å; C189-K193 VanDerWaalsContact O-CB 3.24Å; C189-K193 WeakPolarHBondContact O-CB 3.41Å; C189-K193 PolarHBondContact O-N 3.47Å
190	S	82.3	Confident	70.9	Confident	69 Å²	69	62.6 Å²	62.6	48%	0.483	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-39.1	-179.8	-61.1	0	0	0	0	112.4	T187 F188 K194	T187-S190 PolarHBondContact O-N 3.36Å; T187-S190 VanDerWaalsContact O-N 3.08Å; T187-S190 WeakPolarHBondContact OG1-CB 3.45Å; T187-S190 PolarHBondContact OG1-N 2.96Å; T187-S190 PolarHBondContact OG1-OG 3.4Å; F188-S190 PolarHBondContact O-N 3.38Å; S190-K194 PolarHBondContact O-N 3.14Å
191	K	84	Confident	71.9	Confident	42 Å²	42	64.2 Å²	64.2	18%	0.183	35%	0.348	C	S	.	.	H	α-helix	trans	-70.2	-45.3	-179.9	-167.4	71.2	174.6	-164.8	0	111.2	L149 D162 T187 F188 C189 K194 F195	L149-K191 HydrophobicContact CD2-CG 4.17Å; D162-K191 IonicContact OD2-NZ 3.96Å; T187-K191 PolarHBondContact O-N 3.47Å; F188-K191 PolarHBondContact O-N 3.42Å; C189-K191 PolarHBondContact O-N 2.91Å; K191-K194 PolarHBondContact O-N 3.46Å; K191-F195 PolarHBondContact O-N 2.82Å
192	M	86.7	Confident	73.3	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-64.6	-40.8	178.3	-171.5	64	74.6	0	0	111.2	L60 V94 V122 L149 F188 C189 K194 F195 L196	L60-M192 HydrophobicContact CD2-CB 3.51Å; L60-M192 HydrophobicContact CD2-CG 3.26Å; V94-M192 HydrophobicContact CG1-CE 4.45Å; V94-M192 HydrophobicContact CG2-CE 4.44Å; V122-M192 HydrophobicContact CG1-CE 4.26Å; L149-M192 HydrophobicContact CD1-CE 4.13Å; F188-M192 HydrophobicContact CE1-CB 4.42Å; F188-M192 HydrophobicContact CE1-CE 4.24Å; F188-M192 HydrophobicContact CE2-CE 4.21Å; F188-M192 HydrophobicContact CZ-CE 3.61Å; F188-M192 PolarHBondContact O-N 3.36Å; C189-M192 PolarHBondContact O-N 2.93Å; M192-K194 VanDerWaalsContact C-N 3.3Å; M192-K194 PolarHBondContact O-N 3.31Å; M192-F195 PolarHBondContact O-N 3.23Å; M192-F195 HydrophobicContact SD-CD1 4.3Å; M192-L196 HydrophobicContact CG-CD1 4.24Å; M192-L196 HydrophobicContact CG-CG 4.45Å; M192-L196 WeakPolarHBondContact O-CG 2.98Å; M192-L196 PolarHBondContact O-N 3.14Å
193	K	84.1	Confident	74.1	Confident	82 Å²	82	64.7 Å²	64.7	36%	0.357	34%	0.342	S	S	.	.	H	α-helix	trans	-57.5	-39.9	174.7	-172.4	165.8	-172	170.7	0	113.2	L60 M64 C189 K197	L60-K193 HydrophobicContact CD1-CB 3.72Å; L60-K193 HydrophobicContact CD1-CD 4.23Å; L60-K193 HydrophobicContact CD1-CG 4.09Å; M64-K193 HydrophobicContact SD-CB 4.27Å; M64-K193 HydrophobicContact SD-CG 3.77Å; C189-K193 VanDerWaalsContact O-CB 3.24Å; C189-K193 WeakPolarHBondContact O-CB 3.41Å; C189-K193 PolarHBondContact O-N 3.47Å; K193-K197 WeakPolarHBondContact O-CG 3.46Å; K193-K197 PolarHBondContact O-N 3.36Å
194	K	82.9	Confident	75	Confident	131 Å²	131	57.5 Å²	57.5	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-65.5	-47.1	176.8	-178	177.2	173.7	175.8	0	111.2	S190 K191 M192 K197 E198	S190-K194 PolarHBondContact O-N 3.14Å; K191-K194 PolarHBondContact O-N 3.46Å; M192-K194 VanDerWaalsContact C-N 3.3Å; M192-K194 PolarHBondContact O-N 3.31Å; K194-K197 PolarHBondContact O-N 2.91Å; K194-E198 WeakPolarHBondContact CE-OE1 3.46Å; K194-E198 PolarHBondContact O-N 2.87Å
195	F	84.1	Confident	75.5	Confident	28 Å²	28	53 Å²	53	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-48.7	179.1	175.9	-104	0	0	0	111.8	V92 V122 K147 K191 M192 K197 E198 V199	V92-F195 HydrophobicContact CG1-CE1 3.86Å; V92-F195 HydrophobicContact CG2-CE1 4.48Å; V122-F195 HydrophobicContact CG2-CD1 3.86Å; V122-F195 HydrophobicContact CG2-CE1 3.27Å; V122-F195 HydrophobicContact CG2-CE2 4.46Å; V122-F195 HydrophobicContact CG2-CZ 3.62Å; K147-F195 HydrophobicContact CB-CE2 4.16Å; K147-F195 HydrophobicContact CG-CD2 4.22Å; K147-F195 HydrophobicContact CG-CE2 4.2Å; K191-F195 PolarHBondContact O-N 2.82Å; M192-F195 PolarHBondContact O-N 3.23Å; M192-F195 HydrophobicContact SD-CD1 4.3Å; F195-K197 VanDerWaalsContact C-N 3.29Å; F195-K197 PolarHBondContact O-N 2.79Å; F195-E198 WeakPolarHBondContact O-CB 3.34Å; F195-E198 PolarHBondContact O-N 2.88Å; F195-E198 VanDerWaalsContact O-N 3.09Å; F195-V199 HydrophobicContact CD1-CG2 4.3Å; F195-V199 HydrophobicContact CE1-CG2 3.89Å; F195-V199 HydrophobicContact CE2-CG2 4.12Å; F195-V199 HydrophobicContact CZ-CG2 3.8Å; F195-V199 WeakPolarHBondContact O-CG2 3.3Å; F195-V199 PolarHBondContact O-N 3.4Å; F195-V199 VanDerWaalsContact O-N 3.11Å
196	L	83.2	Confident	76.2	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-33.8	-179	-66.6	176.9	0	0	0	113.4	I35 L60 M64 V92 M192 Q200	I35-L196 HydrophobicContact CD1-CD1 3.66Å; I35-L196 HydrophobicContact CD1-CD2 3.59Å; I35-L196 HydrophobicContact CD1-CG 4.28Å; I35-L196 HydrophobicContact CG1-CD2 4.28Å; L60-L196 HydrophobicContact CD2-CD1 3.81Å; L60-L196 HydrophobicContact CG-CD1 4.34Å; M64-L196 HydrophobicContact CE-CB 3.67Å; M64-L196 HydrophobicContact CE-CD1 4.49Å; M64-L196 HydrophobicContact SD-CB 4.06Å; M64-L196 HydrophobicContact SD-CD1 3.95Å; V92-L196 HydrophobicContact CG1-CD2 4.44Å; V92-L196 HydrophobicContact CG2-CD2 4.13Å; M192-L196 HydrophobicContact CG-CD1 4.24Å; M192-L196 HydrophobicContact CG-CG 4.45Å; M192-L196 WeakPolarHBondContact O-CG 2.98Å; M192-L196 PolarHBondContact O-N 3.14Å; L196-Q200 PolarHBondContact O-N 3.1Å
197	K	79.1	Confident	76.2	Confident	118 Å²	118	55.2 Å²	55.2	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-37.3	174	-77.1	-173.8	173.5	-167.8	0	113.1	M64 K193 K194 F195 I201	M64-K197 HydrophobicContact CE-CG 3.94Å; K193-K197 WeakPolarHBondContact O-CG 3.46Å; K193-K197 PolarHBondContact O-N 3.36Å; K194-K197 PolarHBondContact O-N 2.91Å; F195-K197 VanDerWaalsContact C-N 3.29Å; F195-K197 PolarHBondContact O-N 2.79Å; K197-I201 PolarHBondContact O-N 2.74Å
198	E	76.1	Confident	76	Confident	93 Å²	93	57 Å²	57	44%	0.435	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-45.4	177	-70.9	168.5	-179.3	0	0	110.3	K194 F195 Q200 I201 E202	K194-E198 WeakPolarHBondContact CE-OE1 3.46Å; K194-E198 PolarHBondContact O-N 2.87Å; F195-E198 WeakPolarHBondContact O-CB 3.34Å; F195-E198 PolarHBondContact O-N 2.88Å; F195-E198 VanDerWaalsContact O-N 3.09Å; E198-Q200 VanDerWaalsContact C-N 3.31Å; E198-Q200 PolarHBondContact O-N 2.76Å; E198-I201 PolarHBondContact O-N 2.63Å; E198-E202 PolarHBondContact O-N 2.82Å
199	V	77.2	Confident	75.3	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-58.9	-41	177.1	178.2	0	0	0	0	112.2	L33 V92 Y120 F195 I201 E202 A203	L33-V199 HydrophobicContact CD2-CB 4.4Å; L33-V199 HydrophobicContact CD2-CG1 3.87Å; V92-V199 HydrophobicContact CG2-CG1 3.92Å; V92-V199 HydrophobicContact CG2-CG2 4.34Å; Y120-V199 HydrophobicContact CD1-CB 4.3Å; Y120-V199 HydrophobicContact CD1-CG1 4.01Å; Y120-V199 HydrophobicContact CD1-CG2 3.53Å; Y120-V199 HydrophobicContact CD2-CG1 3.57Å; Y120-V199 HydrophobicContact CE1-CB 4.36Å; Y120-V199 HydrophobicContact CE1-CG1 4.15Å; Y120-V199 HydrophobicContact CE1-CG2 3.92Å; Y120-V199 HydrophobicContact CE2-CG1 3.73Å; Y120-V199 HydrophobicContact CG-CB 4.43Å; Y120-V199 HydrophobicContact CG-CG1 3.7Å; Y120-V199 HydrophobicContact CG-CG2 3.88Å; F195-V199 HydrophobicContact CD1-CG2 4.3Å; F195-V199 HydrophobicContact CE1-CG2 3.89Å; F195-V199 HydrophobicContact CE2-CG2 4.12Å; F195-V199 HydrophobicContact CZ-CG2 3.8Å; F195-V199 WeakPolarHBondContact O-CG2 3.3Å; F195-V199 PolarHBondContact O-N 3.4Å; F195-V199 VanDerWaalsContact O-N 3.11Å; V199-I201 VanDerWaalsContact C-N 3.32Å; V199-I201 PolarHBondContact O-N 2.86Å; V199-E202 PolarHBondContact O-N 2.66Å; V199-A203 WeakPolarHBondContact O-CB 3.42Å; V199-A203 PolarHBondContact O-N 2.9Å
200	Q	69.4	Low	75	Confident	43 Å²	43	65.1 Å²	65.1	20%	0.201	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-37.2	-178.6	-167.2	165.4	16.4	0	0	112.9	F29 L33 L196 E198	F29-Q200 HydrophobicContact CD1-CG 4.18Å; F29-Q200 HydrophobicContact CD2-CG 4.32Å; F29-Q200 HydrophobicContact CE1-CG 4.13Å; F29-Q200 HydrophobicContact CE2-CG 4.26Å; F29-Q200 HydrophobicContact CG-CG 4.28Å; F29-Q200 HydrophobicContact CZ-CG 4.16Å; L33-Q200 HydrophobicContact CD1-CB 3.76Å; L33-Q200 HydrophobicContact CD1-CG 3.77Å; L196-Q200 PolarHBondContact O-N 3.1Å; E198-Q200 VanDerWaalsContact C-N 3.31Å; E198-Q200 PolarHBondContact O-N 2.76Å
201	I	63.5	Low	75.1	Confident	119 Å²	119	61.8 Å²	61.8	61%	0.61	30%	0.297	S	S	*	.	H	α-helix	trans	-73.1	-43.9	178.5	-64.3	169.5	0	0	0	110.9	K197 E198 V199 A203 A205	K197-I201 PolarHBondContact O-N 2.74Å; E198-I201 PolarHBondContact O-N 2.63Å; V199-I201 VanDerWaalsContact C-N 3.32Å; V199-I201 PolarHBondContact O-N 2.86Å; I201-A203 PolarHBondContact O-N 3.41Å; I201-A205 PolarHBondContact O-N 3.01Å
202	E	67.6	Low	74.9	Confident	110 Å²	110	61.4 Å²	61.4	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-34.8	-179	-72.2	-173.4	157.1	0	0	112.6	Y120 E198 V199 S204 A205 H206	Y120-E202 WeakPolarHBondContact CE1-OE2 3.13Å; Y120-E202 WeakPolarHBondContact OH-CB 3.32Å; Y120-E202 PolarHBondContact OH-OE2 3.4Å; Y120-E202 VanDerWaalsContact OH-OE2 3.1Å; E198-E202 PolarHBondContact O-N 2.82Å; V199-E202 PolarHBondContact O-N 2.66Å; E202-S204 PolarHBondContact O-N 3.35Å; E202-A205 PolarHBondContact O-N 3.43Å; E202-H206 WeakPolarHBondContact O-CB 3.5Å; E202-H206 PolarHBondContact O-N 3.26Å
203	A	64.8	Low	74.3	Confident	24 Å²	24	64.1 Å²	64.1	20%	0.198	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-44.2	177.7	0	0	0	0	0	113	V199 I201 H206 S207	V199-A203 WeakPolarHBondContact O-CB 3.42Å; V199-A203 PolarHBondContact O-N 2.9Å; I201-A203 PolarHBondContact O-N 3.41Å; A203-H206 PolarHBondContact O-N 3.46Å; A203-S207 PolarHBondContact O-N 3.35Å; A203-S207 VanDerWaalsContact O-N 3.14Å; A203-S207 PolarHBondContact O-OG 2.99Å
204	S	63.2	Low	74	Confident	22 Å²	22	62 Å²	62	15%	0.154	31%	0.308	C	S	.	.	H	α-helix	trans	-67.6	-40.8	177.8	-179	0	0	0	0	112	E202 H206 S207 R208 D242	E202-S204 PolarHBondContact O-N 3.35Å; S204-H206 VanDerWaalsContact C-N 3.35Å; S204-H206 PolarHBondContact O-N 3.25Å; S204-S207 PolarHBondContact O-N 2.82Å; S204-R208 PolarHBondContact O-N 3.47Å; S204-D242 WeakPolarHBondContact CB-OD1 3.4Å; S204-D242 PolarHBondContact OG-OD1 3.17Å
205	A	63	Low	73.9	Confident	39 Å²	39	55.8 Å²	55.8	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-39.8	174.9	0	0	0	0	0	112.7	I201 E202 R208 E209	I201-A205 PolarHBondContact O-N 3.01Å; E202-A205 PolarHBondContact O-N 3.43Å; A205-R208 PolarHBondContact O-N 3.06Å; A205-E209 PolarHBondContact O-N 2.72Å
206	H	69.8	Low	73.4	Confident	94 Å²	94	60.1 Å²	60.1	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-64.6	-40.1	177.4	-177.4	-101.9	0	0	0	112.3	E202 A203 S204 R208 E209 K210	E202-H206 WeakPolarHBondContact O-CB 3.5Å; E202-H206 PolarHBondContact O-N 3.26Å; A203-H206 PolarHBondContact O-N 3.46Å; S204-H206 VanDerWaalsContact C-N 3.35Å; S204-H206 PolarHBondContact O-N 3.25Å; H206-R208 VanDerWaalsContact C-N 3.33Å; H206-R208 PolarHBondContact O-N 3.06Å; H206-E209 PolarHBondContact O-N 3Å; H206-K210 WeakPolarHBondContact O-CB 3.2Å; H206-K210 PolarHBondContact O-N 2.88Å
207	S	68.8	Low	72.8	Confident	37 Å²	37	65.8 Å²	65.8	26%	0.259	32%	0.323	S	S	.	.	H	α-helix	trans	-58.8	-42.2	175.4	-68	0	0	0	0	112.5	A203 S204 F211	A203-S207 PolarHBondContact O-N 3.35Å; A203-S207 VanDerWaalsContact O-N 3.14Å; A203-S207 PolarHBondContact O-OG 2.99Å; S204-S207 PolarHBondContact O-N 2.82Å; S207-F211 PolarHBondContact O-N 3.13Å
208	R	76.1	Confident	72.5	Confident	96 Å²	96	60.4 Å²	60.4	36%	0.362	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-49.7	176.2	-71.1	-179.4	-81.2	117.1	-7	112.6	S204 A205 H206 K210 F211 L212 D242	S204-R208 PolarHBondContact O-N 3.47Å; A205-R208 PolarHBondContact O-N 3.06Å; H206-R208 VanDerWaalsContact C-N 3.33Å; H206-R208 PolarHBondContact O-N 3.06Å; R208-K210 VanDerWaalsContact C-N 3.28Å; R208-K210 PolarHBondContact O-N 3.21Å; R208-F211 WeakPolarHBondContact O-CB 3.4Å; R208-F211 PolarHBondContact O-N 3.21Å; R208-L212 WeakPolarHBondContact O-CG 3.41Å; R208-L212 PolarHBondContact O-N 3.16Å; R208-D242 VanDerWaalsContact CD-O 3.3Å; R208-D242 WeakPolarHBondContact CD-O 3.48Å; R208-D242 WeakPolarHBondContact CG-O 3.36Å
209	E	72.7	Confident	71.9	Confident	100 Å²	100	57.8 Å²	57.8	47%	0.467	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-37	179.8	-174.8	58.1	-152.9	0	0	111.3	A205 H206 L212 C213 R216	A205-E209 PolarHBondContact O-N 2.72Å; H206-E209 PolarHBondContact O-N 3Å; E209-L212 PolarHBondContact O-N 3.1Å; E209-C213 VanDerWaalsContact O-CB 3.29Å; E209-C213 WeakPolarHBondContact O-CB 3.35Å; E209-C213 PolarHBondContact O-N 2.99Å; E209-R216 IonicContact OE1-CZ 2.87Å; E209-R216 IonicContact OE1-NH1 2.69Å; E209-R216 IonicContact OE1-NH2 3.71Å; E209-R216 PolarHBondContact OE1-NH2 3.37Å
210	K	77	Confident	71	Confident	111 Å²	111	63.6 Å²	63.6	48%	0.483	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-45.1	173.4	-174.3	172.6	-178.2	176.4	0	111.6	H206 R208 L212 C213 D214	H206-K210 WeakPolarHBondContact O-CB 3.2Å; H206-K210 PolarHBondContact O-N 2.88Å; R208-K210 VanDerWaalsContact C-N 3.28Å; R208-K210 PolarHBondContact O-N 3.21Å; K210-L212 PolarHBondContact O-N 3.35Å; K210-C213 WeakPolarHBondContact O-CB 3.48Å; K210-C213 PolarHBondContact O-N 2.94Å; K210-D214 WeakPolarHBondContact O-CB 3.49Å; K210-D214 PolarHBondContact O-N 2.84Å; K210-D214 VanDerWaalsContact O-OD2 3.14Å
211	F	83.4	Confident	70.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.7	-46.1	174.1	177.1	-91.5	0	0	0	112.1	S207 R208 C213 D214 L215 L234 R237 L238 V243 T248 M252	S207-F211 PolarHBondContact O-N 3.13Å; R208-F211 WeakPolarHBondContact O-CB 3.4Å; R208-F211 PolarHBondContact O-N 3.21Å; F211-C213 VanDerWaalsContact C-N 3.33Å; F211-C213 PolarHBondContact O-N 3.45Å; F211-D214 PolarHBondContact O-N 3.46Å; F211-L215 HydrophobicContact CE1-CD2 4.06Å; F211-L215 VanDerWaalsContact O-CB 3.28Å; F211-L215 WeakPolarHBondContact O-CB 3.25Å; F211-L215 PolarHBondContact O-N 2.9Å; F211-L234 HydrophobicContact CE2-CB 4.25Å; F211-L234 WeakPolarHBondContact CE2-O 3.29Å; F211-R237 HydrophobicContact CD2-CB 4.09Å; F211-R237 HydrophobicContact CE2-CB 4.19Å; F211-L238 HydrophobicContact CE1-CD2 3.94Å; F211-L238 HydrophobicContact CE2-CD2 4.13Å; F211-L238 HydrophobicContact CE2-CG 4.1Å; F211-L238 HydrophobicContact CZ-CD1 4.26Å; F211-L238 HydrophobicContact CZ-CD2 3.63Å; F211-L238 HydrophobicContact CZ-CG 3.8Å; F211-V243 HydrophobicContact CB-CG1 3.55Å; F211-V243 HydrophobicContact CD1-CG1 3.95Å; F211-V243 HydrophobicContact CD2-CG1 3.63Å; F211-V243 HydrophobicContact CE2-CG1 4.3Å; F211-V243 HydrophobicContact CG-CG1 3.42Å; F211-V243 VanDerWaalsContact CG-CG1 3.42Å; F211-T248 HydrophobicContact CD1-CG2 3.64Å; F211-T248 HydrophobicContact CE1-CG2 4.11Å; F211-M252 HydrophobicContact CZ-SD 4.24Å
212	L	79.6	Confident	70.2	Confident	33 Å²	33	61.1 Å²	61.1	17%	0.173	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-35.8	176.9	-68.2	174.4	0	0	0	112.1	R208 E209 K210 R216 T248 N251	R208-L212 WeakPolarHBondContact O-CG 3.41Å; R208-L212 PolarHBondContact O-N 3.16Å; E209-L212 PolarHBondContact O-N 3.1Å; K210-L212 PolarHBondContact O-N 3.35Å; L212-R216 WeakPolarHBondContact O-CB 3.39Å; L212-R216 VanDerWaalsContact O-CG 3.24Å; L212-R216 WeakPolarHBondContact O-CG 3.44Å; L212-R216 PolarHBondContact O-N 3.44Å; L212-R216 PolarHBondContact O-NE 3.45Å; L212-T248 HydrophobicContact CD2-CG2 4.01Å; L212-T248 HydrophobicContact CG-CG2 4.11Å; L212-N251 HydrophobicContact CD2-CB 3.92Å
213	C	75	Confident	69.8	Low	61 Å²	61	61.3 Å²	61.3	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-48.8	172.3	-163.9	0	0	0	0	111.7	E209 K210 F211 L215 R216 Q217	E209-C213 VanDerWaalsContact O-CB 3.29Å; E209-C213 WeakPolarHBondContact O-CB 3.35Å; E209-C213 PolarHBondContact O-N 2.99Å; K210-C213 WeakPolarHBondContact O-CB 3.48Å; K210-C213 PolarHBondContact O-N 2.94Å; F211-C213 VanDerWaalsContact C-N 3.33Å; F211-C213 PolarHBondContact O-N 3.45Å; C213-L215 VanDerWaalsContact C-N 3.3Å; C213-L215 PolarHBondContact O-N 3.43Å; C213-R216 CarbonylContact O-C 3.57Å; C213-R216 WeakPolarHBondContact O-CA 3.3Å; C213-R216 WeakPolarHBondContact O-CB 3.38Å; C213-R216 PolarHBondContact O-N 3.06Å; C213-R216 VanDerWaalsContact O-N 3.15Å; C213-Q217 PolarHBondContact O-N 3.3Å
214	D	78.4	Confident	69.8	Low	37 Å²	37	63.5 Å²	63.5	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-65.7	-35.6	179	-63.1	-30.6	0	0	0	111.4	K210 F211 Q217 A218 L234 R237	K210-D214 WeakPolarHBondContact O-CB 3.49Å; K210-D214 PolarHBondContact O-N 2.84Å; K210-D214 VanDerWaalsContact O-OD2 3.14Å; F211-D214 PolarHBondContact O-N 3.46Å; D214-Q217 CarbonylContact O-C 3.55Å; D214-Q217 PolarHBondContact O-N 3.33Å; D214-A218 WeakPolarHBondContact O-CB 3.25Å; D214-A218 PolarHBondContact O-N 3.12Å; D214-L234 HydrophobicContact CB-CD2 4.08Å; D214-R237 IonicContact OD2-CZ 2.82Å; D214-R237 VanDerWaalsContact OD2-CZ 3.22Å; D214-R237 IonicContact OD2-NH1 2.79Å; D214-R237 PolarHBondContact OD2-NH1 3.02Å; D214-R237 IonicContact OD2-NH2 3.14Å; D214-R237 PolarHBondContact OD2-NH2 3.34Å
215	L	79.5	Confident	70.1	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-39.7	173.5	-170.8	64.9	0	0	0	111.5	F211 C213 Q217 A218 R219 L231 L234 N251 M252 S255	F211-L215 HydrophobicContact CE1-CD2 4.06Å; F211-L215 VanDerWaalsContact O-CB 3.28Å; F211-L215 WeakPolarHBondContact O-CB 3.25Å; F211-L215 PolarHBondContact O-N 2.9Å; C213-L215 VanDerWaalsContact C-N 3.3Å; C213-L215 PolarHBondContact O-N 3.43Å; L215-Q217 VanDerWaalsContact C-N 3.29Å; L215-Q217 PolarHBondContact O-N 3.49Å; L215-A218 PolarHBondContact O-N 3.05Å; L215-R219 WeakPolarHBondContact O-CG 3.28Å; L215-R219 PolarHBondContact O-N 3.37Å; L215-L231 HydrophobicContact CD1-CD2 3.57Å; L215-L234 HydrophobicContact CB-CD1 4.27Å; L215-L234 HydrophobicContact CD1-CD1 3.76Å; L215-N251 HydrophobicContact CD2-CB 3.69Å; L215-M252 HydrophobicContact CD1-SD 3.61Å; L215-M252 HydrophobicContact CD2-SD 4.36Å; L215-S255 WeakPolarHBondContact CD1-OG 3.19Å
216	R	74.3	Confident	70.6	Confident	119 Å²	119	68.4 Å²	68.4	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-61.5	-38.5	170.5	-77.7	-179.4	-66.9	-164.8	-1.7	111.3	E209 L212 C213	E209-R216 IonicContact OE1-CZ 2.87Å; E209-R216 IonicContact OE1-NH1 2.69Å; E209-R216 IonicContact OE1-NH2 3.71Å; E209-R216 PolarHBondContact OE1-NH2 3.37Å; L212-R216 WeakPolarHBondContact O-CB 3.39Å; L212-R216 VanDerWaalsContact O-CG 3.24Å; L212-R216 WeakPolarHBondContact O-CG 3.44Å; L212-R216 PolarHBondContact O-N 3.44Å; L212-R216 PolarHBondContact O-NE 3.45Å; C213-R216 CarbonylContact O-C 3.57Å; C213-R216 WeakPolarHBondContact O-CA 3.3Å; C213-R216 WeakPolarHBondContact O-CB 3.38Å; C213-R216 PolarHBondContact O-N 3.06Å; C213-R216 VanDerWaalsContact O-N 3.15Å
217	Q	69.7	Low	70.9	Confident	120 Å²	120	64.2 Å²	64.2	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-70.6	-40.3	175.3	-171.5	-179.4	5.9	0	0	111.8	C213 D214 L215 R219 Q220	C213-Q217 PolarHBondContact O-N 3.3Å; D214-Q217 CarbonylContact O-C 3.55Å; D214-Q217 PolarHBondContact O-N 3.33Å; L215-Q217 VanDerWaalsContact C-N 3.29Å; L215-Q217 PolarHBondContact O-N 3.49Å; Q217-R219 VanDerWaalsContact C-N 3.28Å; Q217-R219 PolarHBondContact O-N 2.97Å; Q217-Q220 WeakPolarHBondContact O-CA 3.37Å; Q217-Q220 WeakPolarHBondContact O-CB 3.4Å; Q217-Q220 PolarHBondContact O-N 3.42Å
218	A	73.8	Confident	71.3	Confident	6 Å²	6	66.8 Å²	66.8	5%	0.05	33%	0.328	C	S	.	.	H	α-helix	trans	-58.6	-42.7	175.6	0	0	0	0	0	110.7	D214 L215 Q220 E221 L227 I230 L231 L234	D214-A218 WeakPolarHBondContact O-CB 3.25Å; D214-A218 PolarHBondContact O-N 3.12Å; L215-A218 PolarHBondContact O-N 3.05Å; A218-Q220 PolarHBondContact O-N 3.48Å; A218-E221 WeakPolarHBondContact O-CB 3.29Å; A218-E221 PolarHBondContact O-N 2.84Å; A218-L227 HydrophobicContact CB-CD1 4.17Å; A218-L227 WeakPolarHBondContact O-CD1 3.28Å; A218-I230 HydrophobicContact CB-CG2 3.48Å; A218-I230 VanDerWaalsContact CB-CG2 3.48Å; A218-L231 HydrophobicContact CB-CD2 4.46Å; A218-L234 HydrophobicContact CB-CD1 3.66Å
219	R	62.9	Low	71.6	Confident	38 Å²	38	67.6 Å²	67.6	14%	0.143	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-12.4	172.2	-68.5	171.1	-175.8	164.1	1.9	113.6	L215 Q217 N251 S255 R274	L215-R219 WeakPolarHBondContact O-CG 3.28Å; L215-R219 PolarHBondContact O-N 3.37Å; Q217-R219 VanDerWaalsContact C-N 3.28Å; Q217-R219 PolarHBondContact O-N 2.97Å; R219-N251 PolarHBondContact NH1-OD1 3.41Å; R219-N251 PolarHBondContact NH2-O 3.42Å; R219-N251 PolarHBondContact NH2-OD1 3.36Å; R219-N251 VanDerWaalsContact NH2-OD1 3.08Å; R219-S255 PolarHBondContact NE-OG 2.9Å; R219-S255 PolarHBondContact NH2-OG 3.27Å; R219-S255 VanDerWaalsContact NH2-OG 3.12Å; R219-R274 WeakPolarHBondContact O-CD 3.28Å; R219-R274 PolarHBondContact O-NE 3.42Å; R219-R274 VanDerWaalsContact O-NE 3.16Å; R219-R274 PolarHBondContact O-NH1 3.31Å
220	Q	58.4	Low	72	Confident	125 Å²	125	65 Å²	65	58%	0.584	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.8	173.2	-52.3	177.2	2.5	0	0	114.8	Q217 A218 P222 R274	Q217-Q220 WeakPolarHBondContact O-CA 3.37Å; Q217-Q220 WeakPolarHBondContact O-CB 3.4Å; Q217-Q220 PolarHBondContact O-N 3.42Å; A218-Q220 PolarHBondContact O-N 3.48Å; Q220-P222 WeakPolarHBondContact O-CD 3.27Å; Q220-R274 PolarHBondContact O-NH1 3.1Å; Q220-R274 PolarHBondContact O-NH2 3.15Å; Q220-R274 VanDerWaalsContact O-NH2 3.16Å
221	E	62.4	Low	72.4	Confident	42 Å²	42	59.7 Å²	59.7	20%	0.196	30%	0.301	C	S	.	.			trans	-72.7	111.8	177.6	176.6	59.1	-126.7	0	0	114.4	A218 Q223 K226 L227 I230 R274	A218-E221 WeakPolarHBondContact O-CB 3.29Å; A218-E221 PolarHBondContact O-N 2.84Å; E221-Q223 VanDerWaalsContact C-N 3.33Å; E221-Q223 PolarHBondContact O-N 3.48Å; E221-K226 HydrophobicContact CG-CB 3.94Å; E221-K226 HydrophobicContact CG-CD 4.47Å; E221-K226 HydrophobicContact CG-CG 4.06Å; E221-L227 HydrophobicContact CB-CB 4.35Å; E221-L227 HydrophobicContact CB-CD1 4.37Å; E221-L227 HydrophobicContact CG-CB 4.31Å; E221-I230 HydrophobicContact CB-CD1 3.71Å; E221-I230 HydrophobicContact CG-CD1 3.65Å; E221-R274 PolarHBondContact O-NH1 3.07Å
222	P	53.1	Low	72.4	Confident	69 Å²	69	62.5 Å²	62.5	45%	0.448	33%	0.325	S	S	.	.	S	Bend	trans	-68.7	-23.4	-166.7	25.5	-35.9	0	0	0	115.1	Q220 R274 A481	Q220-P222 WeakPolarHBondContact O-CD 3.27Å; P222-R274 VanDerWaalsContact CA-NH1 3.34Å; P222-R274 VanDerWaalsContact N-NH1 3.13Å; P222-A481 HydrophobicContact CB-CB 4.26Å
223	Q	59.9	Low	72.6	Confident	113 Å²	113	67.8 Å²	67.8	53%	0.528	35%	0.346	S	S	.	.			trans	-88.9	120.9	179.5	-69.5	-179.7	-16.4	0	0	110.7	E221 S225 K226 L227	E221-Q223 VanDerWaalsContact C-N 3.33Å; E221-Q223 PolarHBondContact O-N 3.48Å; Q223-S225 VanDerWaalsContact C-N 3.3Å; Q223-S225 PolarHBondContact O-N 3.14Å; Q223-K226 HydrophobicContact CB-CB 3.82Å; Q223-K226 PolarHBondContact O-N 3.05Å; Q223-L227 WeakPolarHBondContact O-CB 3.26Å; Q223-L227 PolarHBondContact O-N 2.9Å
224	S	64.4	Low	73	Confident	71 Å²	71	65.5 Å²	65.5	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-37.6	178.9	56.9	0	0	0	0	112.9	L227 K228	S224-L227 PolarHBondContact O-N 3.42Å; S224-K228 WeakPolarHBondContact O-CG 3.42Å; S224-K228 PolarHBondContact O-N 3.14Å
225	S	69.7	Low	73.3	Confident	70 Å²	70	66.2 Å²	66.2	49%	0.49	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-48.6	174.5	52	0	0	0	0	111.9	Q223 L227 K228 E229	Q223-S225 VanDerWaalsContact C-N 3.3Å; Q223-S225 PolarHBondContact O-N 3.14Å; S225-L227 VanDerWaalsContact C-N 3.34Å; S225-L227 PolarHBondContact O-N 3.43Å; S225-K228 WeakPolarHBondContact O-CB 3.49Å; S225-K228 PolarHBondContact O-N 2.79Å; S225-E229 PolarHBondContact O-N 2.96Å; S225-E229 VanDerWaalsContact O-N 3.11Å
226	K	73.1	Confident	73.3	Confident	93 Å²	93	69.7 Å²	69.7	40%	0.404	35%	0.354	S	S	.	.	H	α-helix	trans	-68.7	-34.8	178.9	-164.2	162	179.5	-177.8	0	112.3	E221 Q223 E229 I230	E221-K226 HydrophobicContact CG-CB 3.94Å; E221-K226 HydrophobicContact CG-CD 4.47Å; E221-K226 HydrophobicContact CG-CG 4.06Å; Q223-K226 HydrophobicContact CB-CB 3.82Å; Q223-K226 PolarHBondContact O-N 3.05Å; K226-E229 WeakPolarHBondContact O-CB 3.42Å; K226-E229 PolarHBondContact O-N 3.38Å; K226-I230 HydrophobicContact CG-CD1 4.47Å; K226-I230 VanDerWaalsContact O-CG1 3.28Å; K226-I230 WeakPolarHBondContact O-CG1 3.15Å; K226-I230 PolarHBondContact O-N 3.4Å
227	L	75.9	Confident	73.7	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-41.2	172.4	-178.7	52.6	0	0	0	111.5	A218 E221 Q223 S224 S225 E229 I230 L231 R274 I276	A218-L227 HydrophobicContact CB-CD1 4.17Å; A218-L227 WeakPolarHBondContact O-CD1 3.28Å; E221-L227 HydrophobicContact CB-CB 4.35Å; E221-L227 HydrophobicContact CB-CD1 4.37Å; E221-L227 HydrophobicContact CG-CB 4.31Å; Q223-L227 WeakPolarHBondContact O-CB 3.26Å; Q223-L227 PolarHBondContact O-N 2.9Å; S224-L227 PolarHBondContact O-N 3.42Å; S225-L227 VanDerWaalsContact C-N 3.34Å; S225-L227 PolarHBondContact O-N 3.43Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.39Å; L227-I230 PolarHBondContact O-N 2.89Å; L227-L231 HydrophobicContact CD1-CD2 4.39Å; L227-L231 HydrophobicContact CD1-CG 4.09Å; L227-L231 HydrophobicContact CG-CG 4.44Å; L227-L231 WeakPolarHBondContact O-CB 3.41Å; L227-L231 WeakPolarHBondContact O-CG 3.45Å; L227-L231 PolarHBondContact O-N 3.4Å; L227-R274 HydrophobicContact CD2-CB 4.48Å; L227-I276 HydrophobicContact CB-CD1 4.35Å; L227-I276 HydrophobicContact CD1-CD1 4.45Å; L227-I276 HydrophobicContact CD2-CD1 3.46Å; L227-I276 VanDerWaalsContact CD2-CD1 3.46Å; L227-I276 HydrophobicContact CD2-CG1 3.86Å; L227-I276 HydrophobicContact CG-CD1 3.44Å; L227-I276 VanDerWaalsContact CG-CD1 3.44Å; L227-I276 HydrophobicContact CG-CG1 4.16Å
228	K	78.9	Confident	74.4	Confident	90 Å²	90	62.2 Å²	62.2	39%	0.391	32%	0.321	S	S	.	.	H	α-helix	trans	-56.5	-44.8	170.8	-77.2	-179.2	178.8	-171.8	0	111.5	S224 S225 L231 A232 I276	S224-K228 WeakPolarHBondContact O-CG 3.42Å; S224-K228 PolarHBondContact O-N 3.14Å; S225-K228 WeakPolarHBondContact O-CB 3.49Å; S225-K228 PolarHBondContact O-N 2.79Å; K228-L231 PolarHBondContact O-N 3.06Å; K228-A232 WeakPolarHBondContact O-CB 3.28Å; K228-A232 PolarHBondContact O-N 3.43Å; K228-I276 HydrophobicContact CD-CG2 4.16Å; K228-I276 VanDerWaalsContact CE-CG2 3.47Å; K228-I276 VanDerWaalsContact CE-O 3.27Å; K228-I276 WeakPolarHBondContact CE-O 3.39Å; K228-I276 HydrophobicContact CG-CG2 3.55Å; K228-I276 PolarHBondContact NZ-O 3.38Å
229	E	81.3	Confident	74.5	Confident	113 Å²	113	68.5 Å²	68.5	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-41.5	175.2	-67.1	175.5	-167.8	0	0	112.6	S225 K226 L227 A232 K233	S225-E229 PolarHBondContact O-N 2.96Å; S225-E229 VanDerWaalsContact O-N 3.11Å; K226-E229 WeakPolarHBondContact O-CB 3.42Å; K226-E229 PolarHBondContact O-N 3.38Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.39Å; E229-A232 PolarHBondContact O-N 3.49Å; E229-K233 WeakPolarHBondContact O-CG 3.45Å; E229-K233 PolarHBondContact O-N 3.14Å
230	I	81.4	Confident	75	Confident	45 Å²	45	69.8 Å²	69.8	23%	0.231	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-43.9	177.2	-66	167.4	0	0	0	110.6	A218 E221 K226 L227 A232 K233 L234	A218-I230 HydrophobicContact CB-CG2 3.48Å; A218-I230 VanDerWaalsContact CB-CG2 3.48Å; E221-I230 HydrophobicContact CB-CD1 3.71Å; E221-I230 HydrophobicContact CG-CD1 3.65Å; K226-I230 HydrophobicContact CG-CD1 4.47Å; K226-I230 VanDerWaalsContact O-CG1 3.28Å; K226-I230 WeakPolarHBondContact O-CG1 3.15Å; K226-I230 PolarHBondContact O-N 3.4Å; L227-I230 PolarHBondContact O-N 2.89Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 3.45Å; I230-K233 CarbonylContact O-C 3.51Å; I230-K233 WeakPolarHBondContact O-CB 3.31Å; I230-K233 PolarHBondContact O-N 3.32Å; I230-K233 VanDerWaalsContact O-N 3.16Å; I230-L234 HydrophobicContact CG2-CD1 4.24Å; I230-L234 HydrophobicContact CG2-CG 4.37Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 2.62Å
231	L	85	Confident	75.7	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-38.3	176.2	-69.8	-170.9	0	0	0	111.4	L215 A218 L227 K228 K233 L234 R235 M252 Y256 I276	L215-L231 HydrophobicContact CD1-CD2 3.57Å; A218-L231 HydrophobicContact CB-CD2 4.46Å; L227-L231 HydrophobicContact CD1-CD2 4.39Å; L227-L231 HydrophobicContact CD1-CG 4.09Å; L227-L231 HydrophobicContact CG-CG 4.44Å; L227-L231 WeakPolarHBondContact O-CB 3.41Å; L227-L231 WeakPolarHBondContact O-CG 3.45Å; L227-L231 PolarHBondContact O-N 3.4Å; K228-L231 PolarHBondContact O-N 3.06Å; L231-K233 VanDerWaalsContact C-N 3.28Å; L231-K233 PolarHBondContact O-N 3.29Å; L231-L234 HydrophobicContact CD2-CD1 4.48Å; L231-L234 PolarHBondContact O-N 3.5Å; L231-R235 WeakPolarHBondContact O-CB 3.29Å; L231-R235 PolarHBondContact O-N 2.89Å; L231-M252 HydrophobicContact CB-CE 3.94Å; L231-M252 HydrophobicContact CD2-CE 4.09Å; L231-M252 HydrophobicContact CD2-SD 4.3Å; L231-M252 WeakPolarHBondContact O-CE 3.38Å; L231-Y256 HydrophobicContact CB-CE1 3.91Å; L231-Y256 HydrophobicContact CD1-CD1 3.79Å; L231-Y256 HydrophobicContact CD1-CE1 3.96Å; L231-Y256 HydrophobicContact CD1-CG 4.47Å; L231-I276 HydrophobicContact CD1-CD1 3.26Å; L231-I276 HydrophobicContact CG-CD1 4.25Å
232	A	83.5	Confident	76.1	Confident	60 Å²	60	68.1 Å²	68.1	50%	0.496	37%	0.365	S	S	.	.	H	α-helix	trans	-60	-39.3	172.7	0	0	0	0	0	111.7	K228 E229 I230 R235	K228-A232 WeakPolarHBondContact O-CB 3.28Å; K228-A232 PolarHBondContact O-N 3.43Å; E229-A232 PolarHBondContact O-N 3.49Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 3.45Å; A232-R235 WeakPolarHBondContact O-CB 3.5Å
233	K	82.9	Confident	77.4	Confident	144 Å²	144	65 Å²	65	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-71.6	-36.7	174.3	-70.2	171.9	-175.6	173.8	0	113.5	E229 I230 L231 R235 S236	E229-K233 WeakPolarHBondContact O-CG 3.45Å; E229-K233 PolarHBondContact O-N 3.14Å; I230-K233 CarbonylContact O-C 3.51Å; I230-K233 WeakPolarHBondContact O-CB 3.31Å; I230-K233 PolarHBondContact O-N 3.32Å; I230-K233 VanDerWaalsContact O-N 3.16Å; L231-K233 VanDerWaalsContact C-N 3.28Å; L231-K233 PolarHBondContact O-N 3.29Å; K233-R235 VanDerWaalsContact C-N 3.34Å; K233-S236 PolarHBondContact O-OG 3.06Å
234	L	84.3	Confident	78.6	Confident	13 Å²	13	61.3 Å²	61.3	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-70.2	-34.7	175.1	-73.5	180	0	0	0	111.1	F211 D214 L215 A218 I230 L231 S236 R237 M252	F211-L234 HydrophobicContact CE2-CB 4.25Å; F211-L234 WeakPolarHBondContact CE2-O 3.29Å; D214-L234 HydrophobicContact CB-CD2 4.08Å; L215-L234 HydrophobicContact CB-CD1 4.27Å; L215-L234 HydrophobicContact CD1-CD1 3.76Å; A218-L234 HydrophobicContact CB-CD1 3.66Å; I230-L234 HydrophobicContact CG2-CD1 4.24Å; I230-L234 HydrophobicContact CG2-CG 4.37Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 2.62Å; L231-L234 HydrophobicContact CD2-CD1 4.48Å; L231-L234 PolarHBondContact O-N 3.5Å; L234-S236 PolarHBondContact O-N 3.15Å; L234-R237 WeakPolarHBondContact O-CB 3.35Å; L234-R237 PolarHBondContact O-N 3.42Å; L234-M252 HydrophobicContact CB-CE 4.32Å
235	R	85.6	Confident	79.5	Confident	51 Å²	51	59.1 Å²	59.1	19%	0.192	31%	0.314	C	S	.	.	H	α-helix	trans	-54.6	-39.8	176	-175.4	177.2	175.4	170.9	-3.2	111.9	L231 A232 K233 R237 L238 M252 Y256 S284 L285 D288	L231-R235 WeakPolarHBondContact O-CB 3.29Å; L231-R235 PolarHBondContact O-N 2.89Å; A232-R235 WeakPolarHBondContact O-CB 3.5Å; K233-R235 VanDerWaalsContact C-N 3.34Å; R235-R237 PolarHBondContact O-N 2.85Å; R235-R237 VanDerWaalsContact O-N 3.1Å; R235-L238 WeakPolarHBondContact O-CB 3.17Å; R235-L238 PolarHBondContact O-N 3.49Å; R235-M252 HydrophobicContact CB-CE 3.98Å; R235-Y256 WeakPolarHBondContact CD-OH 3.5Å; R235-S284 PolarHBondContact NH2-O 3.34Å; R235-S284 PolarHBondContact NH2-OG 3.35Å; R235-L285 HydrophobicContact CG-CD1 4.43Å; R235-D288 IonicContact CZ-OD2 3.7Å; R235-D288 IonicContact NH2-OD2 3.82Å; R235-D288 PolarHBondContact NH2-OD2 3.23Å
236	S	79.3	Confident	80.1	Confident	74 Å²	74	58.2 Å²	58.2	52%	0.517	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.4	178.2	72.1	0	0	0	0	114.2	K233 L234	K233-S236 PolarHBondContact O-OG 3.06Å; L234-S236 PolarHBondContact O-N 3.15Å
237	R	82.6	Confident	80.5	Confident	75 Å²	75	59 Å²	59	28%	0.283	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.8	172.9	-66.8	169.2	58.7	-179.1	0.2	112.9	F211 D214 L234 R235 D239 D240	F211-R237 HydrophobicContact CD2-CB 4.09Å; F211-R237 HydrophobicContact CE2-CB 4.19Å; D214-R237 IonicContact OD2-CZ 2.82Å; D214-R237 VanDerWaalsContact OD2-CZ 3.22Å; D214-R237 IonicContact OD2-NH1 2.79Å; D214-R237 PolarHBondContact OD2-NH1 3.02Å; D214-R237 IonicContact OD2-NH2 3.14Å; D214-R237 PolarHBondContact OD2-NH2 3.34Å; L234-R237 WeakPolarHBondContact O-CB 3.35Å; L234-R237 PolarHBondContact O-N 3.42Å; R235-R237 PolarHBondContact O-N 2.85Å; R235-R237 VanDerWaalsContact O-N 3.1Å; R237-D239 PolarHBondContact O-N 3.06Å; R237-D240 WeakPolarHBondContact O-CB 3.39Å; R237-D240 PolarHBondContact O-N 2.69Å
238	L	83.5	Confident	80.9	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.042	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.6	172.5	-68.8	171.7	0	0	0	112.2	F211 R235 D240 V243 L244 M252 L285	F211-L238 HydrophobicContact CE1-CD2 3.94Å; F211-L238 HydrophobicContact CE2-CD2 4.13Å; F211-L238 HydrophobicContact CE2-CG 4.1Å; F211-L238 HydrophobicContact CZ-CD1 4.26Å; F211-L238 HydrophobicContact CZ-CD2 3.63Å; F211-L238 HydrophobicContact CZ-CG 3.8Å; R235-L238 WeakPolarHBondContact O-CB 3.17Å; R235-L238 PolarHBondContact O-N 3.49Å; L238-D240 PolarHBondContact O-N 3.49Å; L238-V243 HydrophobicContact CD2-CG1 4.21Å; L238-L244 HydrophobicContact CB-CD1 4.49Å; L238-M252 HydrophobicContact CD1-CB 4.28Å; L238-M252 HydrophobicContact CD1-CG 4.04Å; L238-L285 HydrophobicContact CD1-CD1 3.99Å; L238-L285 HydrophobicContact CD1-CD2 4.43Å
239	D	75.5	Confident	81.2	Confident	138 Å²	138	54.4 Å²	54.4	74%	0.738	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.3	169.3	-64.6	-21.4	0	0	0	111.9	R237 P241	R237-D239 PolarHBondContact O-N 3.06Å; D239-P241 WeakPolarHBondContact O-CD 3.29Å
240	D	74.9	Confident	81.3	Confident	65 Å²	65	50.1 Å²	50.1	35%	0.348	28%	0.275	S	S	.	.	S	Bend	trans	-75.5	118.6	174.2	-171.8	-16.2	0	0	0	110.1	R237 L238 D242 V243 L244	R237-D240 WeakPolarHBondContact O-CB 3.39Å; R237-D240 PolarHBondContact O-N 2.69Å; L238-D240 PolarHBondContact O-N 3.49Å; D240-D242 PolarHBondContact O-N 3.09Å; D240-D242 WeakPolarHBondContact OD1-CB 2.84Å; D240-D242 PolarHBondContact OD1-N 3.35Å; D240-V243 HydrophobicContact CB-CB 4.23Å; D240-V243 HydrophobicContact CB-CG2 3.95Å; D240-V243 PolarHBondContact O-N 3.17Å; D240-L244 PolarHBondContact O-N 3.39Å
241	P	71.5	Confident	81.3	Confident	92 Å²	92	50.1 Å²	50.1	60%	0.597	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.9	178.1	25.2	-34.7	0	0	0	113.2	D239 V243	D239-P241 WeakPolarHBondContact O-CD 3.29Å; P241-V243 PolarHBondContact O-N 3.45Å
242	D	71.8	Confident	81.4	Confident	39 Å²	39	50.1 Å²	50.1	21%	0.209	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.3	175.7	-80.7	-43.1	0	0	0	112.1	S204 R208 D240	S204-D242 WeakPolarHBondContact CB-OD1 3.4Å; S204-D242 PolarHBondContact OG-OD1 3.17Å; R208-D242 VanDerWaalsContact CD-O 3.3Å; R208-D242 WeakPolarHBondContact CD-O 3.48Å; R208-D242 WeakPolarHBondContact CG-O 3.36Å; D240-D242 PolarHBondContact O-N 3.09Å; D240-D242 WeakPolarHBondContact OD1-CB 2.84Å; D240-D242 PolarHBondContact OD1-N 3.35Å
243	V	81.2	Confident	81.4	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.024	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-30.1	-178.6	-176.5	0	0	0	0	111.9	F211 L238 D240 P241 S245 T248	F211-V243 HydrophobicContact CB-CG1 3.55Å; F211-V243 HydrophobicContact CD1-CG1 3.95Å; F211-V243 HydrophobicContact CD2-CG1 3.63Å; F211-V243 HydrophobicContact CE2-CG1 4.3Å; F211-V243 HydrophobicContact CG-CG1 3.42Å; F211-V243 VanDerWaalsContact CG-CG1 3.42Å; L238-V243 HydrophobicContact CD2-CG1 4.21Å; D240-V243 HydrophobicContact CB-CB 4.23Å; D240-V243 HydrophobicContact CB-CG2 3.95Å; D240-V243 PolarHBondContact O-N 3.17Å; P241-V243 PolarHBondContact O-N 3.45Å; V243-S245 PolarHBondContact O-N 3.15Å; V243-S245 VanDerWaalsContact O-N 3.1Å; V243-T248 HydrophobicContact CG1-CG2 4.4Å; V243-T248 WeakPolarHBondContact O-CB 3.31Å; V243-T248 VanDerWaalsContact O-CG2 3.31Å; V243-T248 WeakPolarHBondContact O-CG2 3.26Å; V243-T248 PolarHBondContact O-OG1 3.2Å
244	L	83.7	Confident	81	Confident	35 Å²	35	42.1 Å²	42.1	18%	0.183	23%	0.231	C	C	.	.			trans	-69.7	103.5	-175.4	-173.5	63.8	0	0	0	111.8	L238 D240 V249 I289 I292 I297	L238-L244 HydrophobicContact CB-CD1 4.49Å; D240-L244 PolarHBondContact O-N 3.39Å; L244-V249 HydrophobicContact CD1-CG2 3.86Å; L244-I289 HydrophobicContact CD1-CG1 4.45Å; L244-I292 HydrophobicContact CD2-CD1 3.78Å; L244-I297 HydrophobicContact CD1-CD1 4.42Å; L244-I297 HydrophobicContact CD2-CD1 4.36Å; L244-I297 HydrophobicContact CG-CD1 3.76Å
245	S	83	Confident	80.7	Confident	26 Å²	26	41.7 Å²	41.7	18%	0.182	23%	0.229	C	C	.	.			trans	-145.1	165.4	-179.4	69.4	0	0	0	0	110.8	V243 D247 T248 V249	V243-S245 PolarHBondContact O-N 3.15Å; V243-S245 VanDerWaalsContact O-N 3.1Å; S245-D247 VanDerWaalsContact C-N 3.28Å; S245-D247 PolarHBondContact O-N 3.06Å; S245-T248 PolarHBondContact N-OG1 3.39Å; S245-T248 PolarHBondContact O-N 3.42Å; S245-T248 PolarHBondContact O-OG1 2.97Å; S245-T248 WeakPolarHBondContact OG-CG2 3.44Å; S245-T248 PolarHBondContact OG-N 3.28Å; S245-T248 PolarHBondContact OG-OG1 2.7Å; S245-V249 VanDerWaalsContact O-CG2 3.28Å; S245-V249 WeakPolarHBondContact O-CG2 3.41Å; S245-V249 PolarHBondContact O-N 3.4Å
246	V	83.7	Confident	80.3	Confident	51 Å²	51	39.6 Å²	39.6	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-56.2	-45.2	176.6	178.4	0	0	0	0	110.9	T248 V249 V250 I297 S300 I303	V246-T248 PolarHBondContact O-N 2.8Å; V246-V249 PolarHBondContact O-N 3.35Å; V246-V250 HydrophobicContact CG1-CG2 4.18Å; V246-V250 WeakPolarHBondContact O-CB 3.31Å; V246-V250 VanDerWaalsContact O-CG2 3.26Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 3.04Å; V246-I297 HydrophobicContact CG2-CB 4.47Å; V246-I297 HydrophobicContact CG2-CG1 4.29Å; V246-I297 HydrophobicContact CG2-CG2 4.14Å; V246-S300 WeakPolarHBondContact CG1-OG 3.33Å; V246-I303 HydrophobicContact CG1-CD1 4.23Å
247	D	80.2	Confident	79.6	Confident	109 Å²	109	36.3 Å²	36.3	58%	0.583	20%	0.198	S	C	*	.	H	α-helix	trans	-65.9	-40.1	-177.5	-64.6	-44.9	0	0	0	112.9	S245 N251	S245-D247 VanDerWaalsContact C-N 3.28Å; S245-D247 PolarHBondContact O-N 3.06Å; D247-N251 VanDerWaalsContact O-CB 3.29Å; D247-N251 WeakPolarHBondContact O-CB 3.42Å; D247-N251 PolarHBondContact O-N 3.38Å; D247-N251 PolarHBondContact O-ND2 2.86Å
248	T	84.7	Confident	78.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.8	-40.1	179.1	52.7	0	0	0	0	111.4	F211 L212 V243 S245 V246 M252	F211-T248 HydrophobicContact CD1-CG2 3.64Å; F211-T248 HydrophobicContact CE1-CG2 4.11Å; L212-T248 HydrophobicContact CD2-CG2 4.01Å; L212-T248 HydrophobicContact CG-CG2 4.11Å; V243-T248 HydrophobicContact CG1-CG2 4.4Å; V243-T248 WeakPolarHBondContact O-CB 3.31Å; V243-T248 VanDerWaalsContact O-CG2 3.31Å; V243-T248 WeakPolarHBondContact O-CG2 3.26Å; V243-T248 PolarHBondContact O-OG1 3.2Å; S245-T248 PolarHBondContact N-OG1 3.39Å; S245-T248 PolarHBondContact O-N 3.42Å; S245-T248 PolarHBondContact O-OG1 2.97Å; S245-T248 WeakPolarHBondContact OG-CG2 3.44Å; S245-T248 PolarHBondContact OG-N 3.28Å; S245-T248 PolarHBondContact OG-OG1 2.7Å; V246-T248 PolarHBondContact O-N 2.8Å; T248-M252 WeakPolarHBondContact O-CB 3.48Å; T248-M252 PolarHBondContact O-N 3.09Å
249	V	86.7	Confident	76.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-48.3	176.3	174.9	0	0	0	0	111.3	L244 S245 V246 N251 M252 L253 I289 I297 I303	L244-V249 HydrophobicContact CD1-CG2 3.86Å; S245-V249 VanDerWaalsContact O-CG2 3.28Å; S245-V249 WeakPolarHBondContact O-CG2 3.41Å; S245-V249 PolarHBondContact O-N 3.4Å; V246-V249 PolarHBondContact O-N 3.35Å; V249-N251 VanDerWaalsContact C-N 3.32Å; V249-N251 PolarHBondContact O-N 3.21Å; V249-M252 WeakPolarHBondContact O-CA 3.24Å; V249-M252 WeakPolarHBondContact O-CB 3.48Å; V249-M252 PolarHBondContact O-N 3.21Å; V249-L253 HydrophobicContact CG1-CD1 4.13Å; V249-L253 HydrophobicContact CG1-CG 4.38Å; V249-L253 WeakPolarHBondContact O-CG 3.48Å; V249-L253 PolarHBondContact O-N 2.98Å; V249-I289 HydrophobicContact CB-CD1 4.17Å; V249-I289 HydrophobicContact CG1-CD1 3.47Å; V249-I289 VanDerWaalsContact CG1-CD1 3.47Å; V249-I289 HydrophobicContact CG2-CD1 3.53Å; V249-I297 HydrophobicContact CG2-CG2 4.19Å; V249-I303 HydrophobicContact CB-CD1 3.93Å; V249-I303 HydrophobicContact CG1-CD1 3.64Å; V249-I303 HydrophobicContact CG1-CG1 4.05Å
250	V	82.7	Confident	74.2	Confident	23 Å²	23	31.4 Å²	31.4	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-45.7	176.9	170.7	0	0	0	0	110.3	V246 M252 L253 L254 A302 I303	V246-V250 HydrophobicContact CG1-CG2 4.18Å; V246-V250 WeakPolarHBondContact O-CB 3.31Å; V246-V250 VanDerWaalsContact O-CG2 3.26Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 3.04Å; V250-M252 VanDerWaalsContact C-N 3.27Å; V250-M252 PolarHBondContact O-N 3.38Å; V250-L253 PolarHBondContact O-N 3.25Å; V250-L254 HydrophobicContact CG1-CD1 3.86Å; V250-L254 HydrophobicContact CG1-CG 4.27Å; V250-L254 WeakPolarHBondContact O-CB 3.11Å; V250-L254 VanDerWaalsContact O-CG 3.23Å; V250-L254 WeakPolarHBondContact O-CG 3.43Å; V250-L254 PolarHBondContact O-N 3.37Å; V250-A302 HydrophobicContact CG2-CB 3.91Å; V250-I303 HydrophobicContact CG2-CD1 4.28Å; V250-I303 HydrophobicContact CG2-CG1 3.57Å
251	N	81.6	Confident	72	Confident	45 Å²	45	35.6 Å²	35.6	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-34.8	176	-86.8	-79.4	0	0	0	112.6	L212 L215 R219 D247 V249 S255	L212-N251 HydrophobicContact CD2-CB 3.92Å; L215-N251 HydrophobicContact CD2-CB 3.69Å; R219-N251 PolarHBondContact NH1-OD1 3.41Å; R219-N251 PolarHBondContact NH2-O 3.42Å; R219-N251 PolarHBondContact NH2-OD1 3.36Å; R219-N251 VanDerWaalsContact NH2-OD1 3.08Å; D247-N251 VanDerWaalsContact O-CB 3.29Å; D247-N251 WeakPolarHBondContact O-CB 3.42Å; D247-N251 PolarHBondContact O-N 3.38Å; D247-N251 PolarHBondContact O-ND2 2.86Å; V249-N251 VanDerWaalsContact C-N 3.32Å; V249-N251 PolarHBondContact O-N 3.21Å; N251-S255 PolarHBondContact O-N 3.37Å; N251-S255 PolarHBondContact O-OG 3.38Å
252	M	85.7	Confident	69.8	Low	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.1	-44.9	175	-164.1	68.7	179.3	0	0	111.7	F211 L215 L231 L234 R235 L238 T248 V249 V250 L254 S255 Y256 L285	F211-M252 HydrophobicContact CZ-SD 4.24Å; L215-M252 HydrophobicContact CD1-SD 3.61Å; L215-M252 HydrophobicContact CD2-SD 4.36Å; L231-M252 HydrophobicContact CB-CE 3.94Å; L231-M252 HydrophobicContact CD2-CE 4.09Å; L231-M252 HydrophobicContact CD2-SD 4.3Å; L231-M252 WeakPolarHBondContact O-CE 3.38Å; L234-M252 HydrophobicContact CB-CE 4.32Å; R235-M252 HydrophobicContact CB-CE 3.98Å; L238-M252 HydrophobicContact CD1-CB 4.28Å; L238-M252 HydrophobicContact CD1-CG 4.04Å; T248-M252 WeakPolarHBondContact O-CB 3.48Å; T248-M252 PolarHBondContact O-N 3.09Å; V249-M252 WeakPolarHBondContact O-CA 3.24Å; V249-M252 WeakPolarHBondContact O-CB 3.48Å; V249-M252 PolarHBondContact O-N 3.21Å; V250-M252 VanDerWaalsContact C-N 3.27Å; V250-M252 PolarHBondContact O-N 3.38Å; M252-L254 VanDerWaalsContact C-N 3.31Å; M252-L254 PolarHBondContact O-N 3.16Å; M252-S255 CarbonylContact O-C 3.25Å; M252-S255 WeakPolarHBondContact O-CA 3.3Å; M252-S255 WeakPolarHBondContact O-CB 3.15Å; M252-S255 PolarHBondContact O-N 2.96Å; M252-Y256 HydrophobicContact CE-CE1 4.39Å; M252-Y256 HydrophobicContact CE-CE2 3.78Å; M252-Y256 WeakPolarHBondContact CE-OH 3.36Å; M252-Y256 HydrophobicContact CG-CD2 4.08Å; M252-Y256 HydrophobicContact CG-CE2 3.64Å; M252-Y256 VanDerWaalsContact O-CD2 3.3Å; M252-Y256 WeakPolarHBondContact O-CD2 3.31Å; M252-Y256 PolarHBondContact O-N 3.43Å; M252-Y256 HydrophobicContact SD-CE2 4.48Å; M252-L285 HydrophobicContact CB-CD2 4Å; M252-L285 HydrophobicContact CG-CD2 3.79Å
253	L	83.8	Confident	67.8	Low	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-40.1	174.7	-67.9	175.5	0	0	0	111.8	V249 V250 S255 Y256 S257 M282 L285 V286 I303 N306	V249-L253 HydrophobicContact CG1-CD1 4.13Å; V249-L253 HydrophobicContact CG1-CG 4.38Å; V249-L253 WeakPolarHBondContact O-CG 3.48Å; V249-L253 PolarHBondContact O-N 2.98Å; V250-L253 PolarHBondContact O-N 3.25Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 3.26Å; L253-Y256 PolarHBondContact O-N 2.99Å; L253-S257 WeakPolarHBondContact O-CB 3.32Å; L253-S257 PolarHBondContact O-N 2.92Å; L253-S257 PolarHBondContact O-OG 2.99Å; L253-M282 HydrophobicContact CB-CE 4.13Å; L253-M282 HydrophobicContact CD2-CB 3.94Å; L253-M282 HydrophobicContact CD2-CE 4.22Å; L253-M282 HydrophobicContact CD2-CG 4.12Å; L253-L285 HydrophobicContact CD2-CD2 4Å; L253-L285 HydrophobicContact CG-CD2 4.35Å; L253-V286 HydrophobicContact CD1-CG2 3.94Å; L253-V286 HydrophobicContact CD2-CG2 3.77Å; L253-V286 HydrophobicContact CG-CG2 4.46Å; L253-I303 HydrophobicContact CD1-CB 4.49Å; L253-I303 HydrophobicContact CD1-CG1 4.38Å; L253-I303 HydrophobicContact CD1-CG2 4.11Å; L253-N306 HydrophobicContact CB-CB 4.3Å; L253-N306 HydrophobicContact CD1-CB 3.99Å
254	L	75.6	Confident	65.2	Low	37 Å²	37	46.1 Å²	46.1	19%	0.194	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-32.4	173.3	-69.3	173.2	0	0	0	112.2	V250 M252 S257 A258 L260	V250-L254 HydrophobicContact CG1-CD1 3.86Å; V250-L254 HydrophobicContact CG1-CG 4.27Å; V250-L254 WeakPolarHBondContact O-CB 3.11Å; V250-L254 VanDerWaalsContact O-CG 3.23Å; V250-L254 WeakPolarHBondContact O-CG 3.43Å; V250-L254 PolarHBondContact O-N 3.37Å; M252-L254 VanDerWaalsContact C-N 3.31Å; M252-L254 PolarHBondContact O-N 3.16Å; L254-S257 VanDerWaalsContact CA-OG 3.27Å; L254-S257 WeakPolarHBondContact CA-OG 3.35Å; L254-S257 PolarHBondContact O-OG 3.19Å; L254-A258 WeakPolarHBondContact O-CA 3.29Å; L254-A258 PolarHBondContact O-N 3.24Å; L254-L260 HydrophobicContact CD1-CD2 4.14Å; L254-L260 HydrophobicContact CD2-CD2 3.87Å; L254-L260 HydrophobicContact CD2-CG 4.31Å; L254-L260 HydrophobicContact CG-CD2 4.48Å
255	S	77.2	Confident	62.5	Low	3 Å²	3	50.9 Å²	50.9	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-73.1	-35.4	174.3	-61.5	0	0	0	0	112.6	L215 R219 N251 M252 L253 A258 I276	L215-S255 WeakPolarHBondContact CD1-OG 3.19Å; R219-S255 PolarHBondContact NE-OG 2.9Å; R219-S255 PolarHBondContact NH2-OG 3.27Å; R219-S255 VanDerWaalsContact NH2-OG 3.12Å; N251-S255 PolarHBondContact O-N 3.37Å; N251-S255 PolarHBondContact O-OG 3.38Å; M252-S255 CarbonylContact O-C 3.25Å; M252-S255 WeakPolarHBondContact O-CA 3.3Å; M252-S255 WeakPolarHBondContact O-CB 3.15Å; M252-S255 PolarHBondContact O-N 2.96Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 3.26Å; S255-A258 WeakPolarHBondContact O-CB 3.19Å; S255-I276 WeakPolarHBondContact O-CD1 3.33Å
256	Y	78.1	Confident	59.8	Low	7 Å²	7	55.5 Å²	55.5	3%	0.027	31%	0.309	C	S	.	.	H	α-helix	trans	-73.5	-41.7	174.3	-75.1	-56.3	0	0	0	113.1	L231 R235 M252 L253 A258 Q277 D278 A281 M282 L285	L231-Y256 HydrophobicContact CB-CE1 3.91Å; L231-Y256 HydrophobicContact CD1-CD1 3.79Å; L231-Y256 HydrophobicContact CD1-CE1 3.96Å; L231-Y256 HydrophobicContact CD1-CG 4.47Å; R235-Y256 WeakPolarHBondContact CD-OH 3.5Å; M252-Y256 HydrophobicContact CE-CE1 4.39Å; M252-Y256 HydrophobicContact CE-CE2 3.78Å; M252-Y256 WeakPolarHBondContact CE-OH 3.36Å; M252-Y256 HydrophobicContact CG-CD2 4.08Å; M252-Y256 HydrophobicContact CG-CE2 3.64Å; M252-Y256 VanDerWaalsContact O-CD2 3.3Å; M252-Y256 WeakPolarHBondContact O-CD2 3.31Å; M252-Y256 PolarHBondContact O-N 3.43Å; M252-Y256 HydrophobicContact SD-CE2 4.48Å; L253-Y256 PolarHBondContact O-N 2.99Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; Y256-Q277 PolarHBondContact O-N 2.89Å; Y256-D278 HydrophobicContact CD1-CB 4.28Å; Y256-D278 PolarHBondContact O-N 3.39Å; Y256-A281 HydrophobicContact CD1-CB 3.82Å; Y256-A281 HydrophobicContact CE1-CB 3.61Å; Y256-A281 HydrophobicContact CE2-CB 4.39Å; Y256-A281 HydrophobicContact CG-CB 4.33Å; Y256-M282 HydrophobicContact CD2-CG 4.29Å; Y256-M282 HydrophobicContact CG-CG 4.13Å; Y256-L285 HydrophobicContact CD2-CD2 4.44Å; Y256-L285 HydrophobicContact CE2-CD2 4.03Å
257	S	63.4	Low	57.2	Low	6 Å²	6	60.9 Å²	60.9	4%	0.042	34%	0.335	C	S	.	.	H	α-helix	trans	-73.9	-29.1	178.5	54.3	0	0	0	0	112.5	L253 L254 T259 M282	L253-S257 WeakPolarHBondContact O-CB 3.32Å; L253-S257 PolarHBondContact O-N 2.92Å; L253-S257 PolarHBondContact O-OG 2.99Å; L254-S257 VanDerWaalsContact CA-OG 3.27Å; L254-S257 WeakPolarHBondContact CA-OG 3.35Å; L254-S257 PolarHBondContact O-OG 3.19Å; S257-T259 PolarHBondContact O-N 3.05Å; S257-T259 PolarHBondContact O-OG1 3.45Å; S257-M282 VanDerWaalsContact CB-SD 3.58Å
258	A	54.8	Low	54.6	Low	15 Å²	15	61.9 Å²	61.9	12%	0.124	34%	0.34	C	S	.	.			trans	8.8	67.1	-171.4	0	0	0	0	0	114.1	L254 S255 Y256 R274	L254-A258 WeakPolarHBondContact O-CA 3.29Å; L254-A258 PolarHBondContact O-N 3.24Å; S255-A258 WeakPolarHBondContact O-CB 3.19Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; A258-R274 WeakPolarHBondContact CB-O 3.35Å
259	T	40.4	Very low	52	Low	50 Å²	50	67.5 Å²	67.5	31%	0.307	38%	0.377	S	S	.	.			trans	-136.9	68.5	163.6	-40.9	0	0	0	0	105.7	S257 F261 R489	S257-T259 PolarHBondContact O-N 3.05Å; S257-T259 PolarHBondContact O-OG1 3.45Å; T259-F261 PolarHBondContact O-N 2.97Å; T259-R489 HydrophobicContact CG2-CG 4.32Å
260	L	34.1	Very low	49.3	Very low	52 Å²	52	74.8 Å²	74.8	27%	0.272	42%	0.415	S	S	.	.			trans	-71.6	124.2	-178.6	-97.5	160.7	0	0	0	110.8	L254 L273 R489	L254-L260 HydrophobicContact CD1-CD2 4.14Å; L254-L260 HydrophobicContact CD2-CD2 3.87Å; L254-L260 HydrophobicContact CD2-CG 4.31Å; L254-L260 HydrophobicContact CG-CD2 4.48Å; L260-L273 HydrophobicContact CB-CD2 3.5Å; L260-L273 VanDerWaalsContact CB-CD2 3.5Å; L260-L273 WeakPolarHBondContact O-CD2 3.33Å; L260-R489 PolarHBondContact O-NH1 3.33Å; L260-R489 PolarHBondContact O-NH2 3.47Å; L260-R489 VanDerWaalsContact O-NH2 3.08Å
261	F	27.7	Very low	46.8	Very low	153 Å²	153	79.3 Å²	79.3	67%	0.671	44%	0.437	S	S	*	.			trans	-75.3	132.5	163.1	-113.6	-99.4	0	0	0	108.5	T259	T259-F261 PolarHBondContact O-N 2.97Å
262	S	26.4	Very low	44.6	Very low	96 Å²	96	78.7 Å²	78.7	67%	0.671	44%	0.436	S	S	*	.			trans	-150.8	93	158.1	179.6	0	0	0	0	108.4
263	S	29.2	Very low	42.4	Very low	89 Å²	89	81.4 Å²	81.4	62%	0.622	45%	0.45	S	S	*	.	S	Bend	trans	-77.9	113.9	157.1	50	0	0	0	0	106.9
264	H	25.7	Very low	40.7	Very low	172 Å²	172	82.5 Å²	82.5	80%	0.796	46%	0.455	S	S	*	.			trans	82.5	94.9	175.8	-45.2	-55.5	0	0	0	116.1
265	L	27.7	Very low	39.3	Very low	134 Å²	134	82.2 Å²	82.2	70%	0.702	45%	0.453	S	S	*	.			trans	-167.5	106.2	138.1	-101.6	156.9	0	0	0	110.3
266	T	26.3	Very low	38.4	Very low	124 Å²	124	82.5 Å²	82.5	76%	0.761	46%	0.455	S	S	*	.			trans	-68.1	131.5	162.8	45.1	0	0	0	0	109.7
267	N	28.6	Very low	37.8	Very low	163 Å²	163	84.2 Å²	84.2	87%	0.872	46%	0.463	S	S	*	.	S	Bend	trans	87.7	35	165.5	-60	-26.5	0	0	0	120.9
268	L	26.4	Very low	38.5	Very low	131 Å²	131	86 Å²	86	69%	0.686	47%	0.472	S	S	*	.	S	Bend	trans	-111.4	144	159.8	-88.9	136.8	0	0	0	111.6	L270	L268-L270 PolarHBondContact O-N 3.2Å
269	P	29.2	Very low	39.9	Very low	117 Å²	117	86.1 Å²	86.1	76%	0.76	47%	0.469	S	S	*	.			trans	-69.3	103.8	-176.2	-6.8	22.6	0	0	0	110.7	I271	P269-I271 PolarHBondContact O-N 2.82Å
270	L	30.4	Very low	42	Very low	153 Å²	153	86.1 Å²	86.1	80%	0.801	47%	0.474	S	S	*	.			trans	18.3	87.4	156.5	-76	130.8	0	0	0	116.9	L268 S272 M482	L268-L270 PolarHBondContact O-N 3.2Å; L270-S272 PolarHBondContact O-N 2.93Å; L270-M482 HydrophobicContact CD2-CE 4.16Å
271	I	31.5	Very low	44.4	Very low	118 Å²	118	84.1 Å²	84.1	61%	0.605	47%	0.465	S	S	*	.			trans	-74.1	117.6	165.1	-61.6	167.4	0	0	0	108.2	P269 L273	P269-I271 PolarHBondContact O-N 2.82Å; I271-L273 PolarHBondContact O-N 3.29Å
272	S	35.1	Very low	47.3	Very low	33 Å²	33	76.9 Å²	76.9	23%	0.231	43%	0.433	C	S	.	.			trans	-65.4	113.5	173.7	-167.3	0	0	0	0	110.2	L270 R274	L270-S272 PolarHBondContact O-N 2.93Å; S272-R274 PolarHBondContact OG-NE 3.48Å; S272-R274 PolarHBondContact OG-NH2 2.92Å
273	L	38.3	Very low	50.2	Low	56 Å²	56	72.5 Å²	72.5	29%	0.293	40%	0.403	S	S	.	.			trans	-77.5	126.8	170.3	-67.9	154.2	0	0	0	108.1	L260 I271 T485	L260-L273 HydrophobicContact CB-CD2 3.5Å; L260-L273 VanDerWaalsContact CB-CD2 3.5Å; L260-L273 WeakPolarHBondContact O-CD2 3.33Å; I271-L273 PolarHBondContact O-N 3.29Å; L273-T485 WeakPolarHBondContact O-CB 3.36Å; L273-T485 WeakPolarHBondContact O-CG2 3.24Å; L273-T485 PolarHBondContact O-OG1 2.87Å; L273-T485 VanDerWaalsContact O-OG1 3.06Å
274	R	47.7	Very low	53	Low	23 Å²	23	70.5 Å²	70.5	9%	0.087	39%	0.389	C	S	.	.			trans	-142.4	127.3	-175.7	-65	-175.9	-173.1	-172.8	4.9	114.7	R219 Q220 E221 P222 L227 A258 S272 I276 T485	R219-R274 WeakPolarHBondContact O-CD 3.28Å; R219-R274 PolarHBondContact O-NE 3.42Å; R219-R274 VanDerWaalsContact O-NE 3.16Å; R219-R274 PolarHBondContact O-NH1 3.31Å; Q220-R274 PolarHBondContact O-NH1 3.1Å; Q220-R274 PolarHBondContact O-NH2 3.15Å; Q220-R274 VanDerWaalsContact O-NH2 3.16Å; E221-R274 PolarHBondContact O-NH1 3.07Å; P222-R274 VanDerWaalsContact CA-NH1 3.34Å; P222-R274 VanDerWaalsContact N-NH1 3.13Å; L227-R274 HydrophobicContact CD2-CB 4.48Å; A258-R274 WeakPolarHBondContact CB-O 3.35Å; S272-R274 PolarHBondContact OG-NE 3.48Å; S272-R274 PolarHBondContact OG-NH2 2.92Å; R274-I276 PolarHBondContact O-N 3.04Å; R274-T485 VanDerWaalsContact CA-CG2 3.43Å; R274-T485 WeakPolarHBondContact CA-OG1 3.22Å
275	D	47.9	Very low	56	Low	32 Å²	32	62.6 Å²	62.6	17%	0.171	35%	0.353	C	S	.	.			trans	-84.5	99.1	-169.3	-143.1	17.3	0	0	0	113.7	Q277 T485 E488	D275-Q277 HydrophobicContact CB-CG 4.43Å; D275-Q277 WeakPolarHBondContact OD1-CG 3.19Å; D275-Q277 PolarHBondContact OD1-NE2 3.18Å; D275-Q277 VanDerWaalsContact OD2-CD 3.23Å; D275-Q277 WeakPolarHBondContact OD2-CG 3.41Å; D275-Q277 PolarHBondContact OD2-NE2 3.38Å; D275-T485 HydrophobicContact CB-CG2 3.99Å; D275-T485 VanDerWaalsContact N-CG2 3.32Å; D275-E488 WeakPolarHBondContact CB-OE2 3.32Å
276	I	56.9	Low	58.9	Low	9 Å²	9	56.3 Å²	56.3	5%	0.046	32%	0.319	C	S	.	.			trans	-91.4	-37.2	170.9	-64.5	177.3	0	0	0	111	L227 K228 L231 S255 R274 D278	L227-I276 HydrophobicContact CB-CD1 4.35Å; L227-I276 HydrophobicContact CD1-CD1 4.45Å; L227-I276 HydrophobicContact CD2-CD1 3.46Å; L227-I276 VanDerWaalsContact CD2-CD1 3.46Å; L227-I276 HydrophobicContact CD2-CG1 3.86Å; L227-I276 HydrophobicContact CG-CD1 3.44Å; L227-I276 VanDerWaalsContact CG-CD1 3.44Å; L227-I276 HydrophobicContact CG-CG1 4.16Å; K228-I276 HydrophobicContact CD-CG2 4.16Å; K228-I276 VanDerWaalsContact CE-CG2 3.47Å; K228-I276 VanDerWaalsContact CE-O 3.27Å; K228-I276 WeakPolarHBondContact CE-O 3.39Å; K228-I276 HydrophobicContact CG-CG2 3.55Å; K228-I276 PolarHBondContact NZ-O 3.38Å; L231-I276 HydrophobicContact CD1-CD1 3.26Å; L231-I276 HydrophobicContact CG-CD1 4.25Å; S255-I276 WeakPolarHBondContact O-CD1 3.33Å; R274-I276 PolarHBondContact O-N 3.04Å; I276-D278 HydrophobicContact CG2-CB 3.74Å; I276-D278 PolarHBondContact O-N 2.95Å; I276-D278 VanDerWaalsContact O-N 3.09Å
277	Q	67	Low	61.9	Low	42 Å²	42	53.1 Å²	53.1	20%	0.196	30%	0.296	C	S	.	.			trans	43.1	38.7	-177.1	-53.4	-150.5	1.4	0	0	115.2	Y256 D275 Y279 R492	Y256-Q277 PolarHBondContact O-N 2.89Å; D275-Q277 HydrophobicContact CB-CG 4.43Å; D275-Q277 WeakPolarHBondContact OD1-CG 3.19Å; D275-Q277 PolarHBondContact OD1-NE2 3.18Å; D275-Q277 VanDerWaalsContact OD2-CD 3.23Å; D275-Q277 WeakPolarHBondContact OD2-CG 3.41Å; D275-Q277 PolarHBondContact OD2-NE2 3.38Å; Q277-Y279 HydrophobicContact CB-CD2 4.35Å; Q277-Y279 HydrophobicContact CB-CE2 3.83Å; Q277-Y279 HydrophobicContact CG-CE2 4.4Å; Q277-Y279 PolarHBondContact O-N 2.91Å; Q277-Y279 PolarHBondContact OE1-OH 2.95Å; Q277-R492 VanDerWaalsContact CD-NH1 3.32Å; Q277-R492 VanDerWaalsContact OE1-CZ 3.26Å
278	D	77.7	Confident	64.6	Low	45 Å²	45	49.2 Å²	49.2	24%	0.241	28%	0.275	C	S	.	.			trans	-84.8	65.5	177.6	-159	-17.6	0	0	0	109.3	Y256 I276 A280 A281 M282	Y256-D278 HydrophobicContact CD1-CB 4.28Å; Y256-D278 PolarHBondContact O-N 3.39Å; I276-D278 HydrophobicContact CG2-CB 3.74Å; I276-D278 PolarHBondContact O-N 2.95Å; I276-D278 VanDerWaalsContact O-N 3.09Å; D278-A280 PolarHBondContact O-N 3.43Å; D278-A281 HydrophobicContact CB-CB 3.88Å; D278-A281 PolarHBondContact O-N 2.95Å; D278-A281 WeakPolarHBondContact OD1-CB 3.36Å; D278-A281 PolarHBondContact OD1-N 2.55Å; D278-M282 PolarHBondContact O-N 3.39Å
279	Y	83.7	Confident	67.5	Low	17 Å²	17	43.3 Å²	43.3	7%	0.067	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-27.4	175.9	-57	-65.4	0	0	0	110.8	Q277 M282 V283 F309 A310 R313	Q277-Y279 HydrophobicContact CB-CD2 4.35Å; Q277-Y279 HydrophobicContact CB-CE2 3.83Å; Q277-Y279 HydrophobicContact CG-CE2 4.4Å; Q277-Y279 PolarHBondContact O-N 2.91Å; Q277-Y279 PolarHBondContact OE1-OH 2.95Å; Y279-M282 HydrophobicContact CD1-SD 3.86Å; Y279-M282 HydrophobicContact CE1-SD 4.48Å; Y279-M282 PolarHBondContact O-N 2.94Å; Y279-V283 WeakPolarHBondContact O-CB 3.49Å; Y279-V283 VanDerWaalsContact O-CG2 3.24Å; Y279-V283 WeakPolarHBondContact O-CG2 3.21Å; Y279-V283 PolarHBondContact O-N 2.99Å; Y279-F309 HydrophobicContact CE1-CD1 4.41Å; Y279-F309 AromaticContact CE1-CE1 3.98Å; Y279-F309 HydrophobicContact CE1-CE1 3.98Å; Y279-A310 HydrophobicContact CD1-CB 4.07Å; Y279-R313 HydrophobicContact CD1-CB 4.06Å; Y279-R313 HydrophobicContact CD2-CB 3.86Å; Y279-R313 HydrophobicContact CE1-CB 3.94Å; Y279-R313 HydrophobicContact CE1-CG 4.13Å; Y279-R313 HydrophobicContact CE2-CB 3.75Å; Y279-R313 HydrophobicContact CE2-CG 4.46Å; Y279-R313 HydrophobicContact CG-CB 4.02Å
280	A	84.5	Confident	70.1	Confident	50 Å²	50	44.4 Å²	44.4	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-46.1	171.6	0	0	0	0	0	111.7	D278 V283 S284	D278-A280 PolarHBondContact O-N 3.43Å; A280-V283 PolarHBondContact O-N 2.94Å; A280-S284 VanDerWaalsContact O-CB 3.24Å; A280-S284 WeakPolarHBondContact O-CB 3.47Å; A280-S284 PolarHBondContact O-N 2.95Å
281	A	85.4	Confident	72.6	Confident	10 Å²	10	41.5 Å²	41.5	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-36.3	173.9	0	0	0	0	0	113	Y256 D278 S284 L285	Y256-A281 HydrophobicContact CD1-CB 3.82Å; Y256-A281 HydrophobicContact CE1-CB 3.61Å; Y256-A281 HydrophobicContact CE2-CB 4.39Å; Y256-A281 HydrophobicContact CG-CB 4.33Å; D278-A281 HydrophobicContact CB-CB 3.88Å; D278-A281 PolarHBondContact O-N 2.95Å; D278-A281 WeakPolarHBondContact OD1-CB 3.36Å; D278-A281 PolarHBondContact OD1-N 2.55Å; A281-S284 PolarHBondContact O-N 2.97Å; A281-L285 WeakPolarHBondContact O-CB 3.27Å; A281-L285 PolarHBondContact O-N 2.97Å
282	M	87.6	Confident	74.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-52.7	173.3	-68.8	178.6	71.8	0	0	111.7	L253 Y256 S257 D278 Y279 S284 L285 V286 N306 A310	L253-M282 HydrophobicContact CB-CE 4.13Å; L253-M282 HydrophobicContact CD2-CB 3.94Å; L253-M282 HydrophobicContact CD2-CE 4.22Å; L253-M282 HydrophobicContact CD2-CG 4.12Å; Y256-M282 HydrophobicContact CD2-CG 4.29Å; Y256-M282 HydrophobicContact CG-CG 4.13Å; S257-M282 VanDerWaalsContact CB-SD 3.58Å; D278-M282 PolarHBondContact O-N 3.39Å; Y279-M282 HydrophobicContact CD1-SD 3.86Å; Y279-M282 HydrophobicContact CE1-SD 4.48Å; Y279-M282 PolarHBondContact O-N 2.94Å; M282-S284 VanDerWaalsContact C-N 3.32Å; M282-S284 PolarHBondContact O-N 3.23Å; M282-L285 PolarHBondContact O-N 3.27Å; M282-V286 WeakPolarHBondContact O-CG2 3.14Å; M282-V286 PolarHBondContact O-N 3.35Å; M282-V286 VanDerWaalsContact O-N 3.13Å; M282-N306 HydrophobicContact CE-CB 4.16Å; M282-A310 HydrophobicContact CB-CB 3.85Å; M282-A310 HydrophobicContact CE-CB 3.92Å; M282-A310 HydrophobicContact SD-CB 3.93Å
283	V	87.5	Confident	76.3	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-59.3	-47.5	178.8	169	0	0	0	0	109.5	Y279 A280 L285 V286 E287 Y307 A310 L311	Y279-V283 WeakPolarHBondContact O-CB 3.49Å; Y279-V283 VanDerWaalsContact O-CG2 3.24Å; Y279-V283 WeakPolarHBondContact O-CG2 3.21Å; Y279-V283 PolarHBondContact O-N 2.99Å; A280-V283 PolarHBondContact O-N 2.94Å; V283-L285 PolarHBondContact O-N 3.27Å; V283-V286 PolarHBondContact O-N 2.93Å; V283-E287 HydrophobicContact CG1-CG 4.33Å; V283-E287 VanDerWaalsContact O-CG 3.27Å; V283-E287 WeakPolarHBondContact O-CG 3.45Å; V283-E287 PolarHBondContact O-N 3.29Å; V283-Y307 HydrophobicContact CB-CE2 4.42Å; V283-Y307 HydrophobicContact CG1-CE2 4.07Å; V283-Y307 HydrophobicContact CG2-CD2 4.49Å; V283-Y307 HydrophobicContact CG2-CE2 4.39Å; V283-A310 HydrophobicContact CG2-CB 4.03Å; V283-L311 HydrophobicContact CG1-CD2 4.02Å; V283-L311 HydrophobicContact CG2-CD2 3.81Å; V283-L311 HydrophobicContact CG2-CG 4.1Å
284	S	88.6	Confident	77.5	Confident	48 Å²	48	48.7 Å²	48.7	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-59.4	-42.1	177.7	174.6	0	0	0	0	112.9	R235 A280 A281 M282 V286 E287 D288	R235-S284 PolarHBondContact NH2-O 3.34Å; R235-S284 PolarHBondContact NH2-OG 3.35Å; A280-S284 VanDerWaalsContact O-CB 3.24Å; A280-S284 WeakPolarHBondContact O-CB 3.47Å; A280-S284 PolarHBondContact O-N 2.95Å; A281-S284 PolarHBondContact O-N 2.97Å; M282-S284 VanDerWaalsContact C-N 3.32Å; M282-S284 PolarHBondContact O-N 3.23Å; S284-V286 PolarHBondContact O-N 3.25Å; S284-E287 PolarHBondContact O-N 2.86Å; S284-D288 WeakPolarHBondContact O-CB 3.44Å; S284-D288 PolarHBondContact O-N 3.41Å
285	L	88.7	Confident	78.5	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-44.4	178.2	174.7	63.5	0	0	0	111.7	R235 L238 M252 L253 Y256 A281 M282 V283 D288 I289	R235-L285 HydrophobicContact CG-CD1 4.43Å; L238-L285 HydrophobicContact CD1-CD1 3.99Å; L238-L285 HydrophobicContact CD1-CD2 4.43Å; M252-L285 HydrophobicContact CB-CD2 4Å; M252-L285 HydrophobicContact CG-CD2 3.79Å; L253-L285 HydrophobicContact CD2-CD2 4Å; L253-L285 HydrophobicContact CG-CD2 4.35Å; Y256-L285 HydrophobicContact CD2-CD2 4.44Å; Y256-L285 HydrophobicContact CE2-CD2 4.03Å; A281-L285 WeakPolarHBondContact O-CB 3.27Å; A281-L285 PolarHBondContact O-N 2.97Å; M282-L285 PolarHBondContact O-N 3.27Å; V283-L285 PolarHBondContact O-N 3.27Å; L285-D288 PolarHBondContact O-N 3.36Å; L285-I289 HydrophobicContact CD1-CD1 3.97Å; L285-I289 HydrophobicContact CD1-CG1 4.4Å; L285-I289 HydrophobicContact CG-CD1 3.97Å; L285-I289 WeakPolarHBondContact O-CD1 3.46Å; L285-I289 VanDerWaalsContact O-CG1 3.28Å; L285-I289 WeakPolarHBondContact O-CG1 3.34Å; L285-I289 PolarHBondContact O-N 2.95Å
286	V	88.4	Confident	79.8	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-70.1	-38.1	-176.9	178.8	0	0	0	0	111.2	L253 M282 V283 S284 I289 R290 Y298 I303 Y307	L253-V286 HydrophobicContact CD1-CG2 3.94Å; L253-V286 HydrophobicContact CD2-CG2 3.77Å; L253-V286 HydrophobicContact CG-CG2 4.46Å; M282-V286 WeakPolarHBondContact O-CG2 3.14Å; M282-V286 PolarHBondContact O-N 3.35Å; M282-V286 VanDerWaalsContact O-N 3.13Å; V283-V286 PolarHBondContact O-N 2.93Å; S284-V286 PolarHBondContact O-N 3.25Å; V286-I289 PolarHBondContact O-N 3.02Å; V286-R290 WeakPolarHBondContact O-CB 3.49Å; V286-R290 PolarHBondContact O-N 3.44Å; V286-Y298 HydrophobicContact CG1-CD2 3.56Å; V286-Y298 HydrophobicContact CG1-CE2 3.52Å; V286-I303 HydrophobicContact CG1-CG2 4.19Å; V286-I303 HydrophobicContact CG2-CG2 4.18Å; V286-Y307 HydrophobicContact CB-CD2 3.55Å; V286-Y307 HydrophobicContact CB-CE2 4.07Å; V286-Y307 HydrophobicContact CB-CG 4.07Å; V286-Y307 HydrophobicContact CG1-CD1 4.16Å; V286-Y307 HydrophobicContact CG1-CD2 3.58Å; V286-Y307 HydrophobicContact CG1-CE2 4.07Å; V286-Y307 HydrophobicContact CG1-CG 3.63Å; V286-Y307 HydrophobicContact CG2-CD2 3.99Å; V286-Y307 HydrophobicContact CG2-CG 4.32Å
287	E	89	Confident	81	Confident	57 Å²	57	55.9 Å²	55.9	27%	0.266	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-38.5	175.3	-63.8	-69.5	-167	0	0	112.2	V283 S284 I289 R290 S291 Y307 R322	V283-E287 HydrophobicContact CG1-CG 4.33Å; V283-E287 VanDerWaalsContact O-CG 3.27Å; V283-E287 WeakPolarHBondContact O-CG 3.45Å; V283-E287 PolarHBondContact O-N 3.29Å; S284-E287 PolarHBondContact O-N 2.86Å; E287-I289 PolarHBondContact O-N 2.72Å; E287-R290 PolarHBondContact O-N 3.44Å; E287-S291 PolarHBondContact O-N 2.86Å; E287-Y307 HydrophobicContact CG-CE2 4.32Å; E287-Y307 PolarHBondContact OE1-OH 3.18Å; E287-R322 IonicContact OE1-NH1 3.26Å
288	D	86.2	Confident	81.8	Confident	82 Å²	82	55.1 Å²	55.1	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-44.4	174.1	-71.3	-7.4	0	0	0	110.9	R235 S284 L285 R290 S291	R235-D288 IonicContact CZ-OD2 3.7Å; R235-D288 IonicContact NH2-OD2 3.82Å; R235-D288 PolarHBondContact NH2-OD2 3.23Å; S284-D288 WeakPolarHBondContact O-CB 3.44Å; S284-D288 PolarHBondContact O-N 3.41Å; L285-D288 PolarHBondContact O-N 3.36Å; D288-R290 VanDerWaalsContact C-N 3.33Å; D288-R290 PolarHBondContact O-N 3.46Å; D288-S291 WeakPolarHBondContact O-CB 3.3Å; D288-S291 PolarHBondContact O-N 3.37Å; D288-S291 VanDerWaalsContact O-N 3.15Å; D288-S291 PolarHBondContact O-OG 2.97Å
289	I	85.8	Confident	82	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-40.5	176.9	-68.2	165.1	0	0	0	111.2	L244 V249 L285 V286 E287 S291 I292 I297	L244-I289 HydrophobicContact CD1-CG1 4.45Å; V249-I289 HydrophobicContact CB-CD1 4.17Å; V249-I289 HydrophobicContact CG1-CD1 3.47Å; V249-I289 VanDerWaalsContact CG1-CD1 3.47Å; V249-I289 HydrophobicContact CG2-CD1 3.53Å; L285-I289 HydrophobicContact CD1-CD1 3.97Å; L285-I289 HydrophobicContact CD1-CG1 4.4Å; L285-I289 HydrophobicContact CG-CD1 3.97Å; L285-I289 WeakPolarHBondContact O-CD1 3.46Å; L285-I289 VanDerWaalsContact O-CG1 3.28Å; L285-I289 WeakPolarHBondContact O-CG1 3.34Å; L285-I289 PolarHBondContact O-N 2.95Å; V286-I289 PolarHBondContact O-N 3.02Å; E287-I289 PolarHBondContact O-N 2.72Å; I289-S291 PolarHBondContact O-N 3.5Å; I289-I292 WeakPolarHBondContact O-CB 3.35Å; I289-I292 PolarHBondContact O-N 2.88Å; I289-I292 VanDerWaalsContact O-N 3.14Å; I289-I297 HydrophobicContact CG2-CB 4.41Å; I289-I297 HydrophobicContact CG2-CG2 4.35Å
290	R	84.2	Confident	82.1	Confident	141 Å²	141	59.1 Å²	59.1	53%	0.532	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-26.9	177	-171.3	-179.5	-179.4	177.3	4.3	112.5	V286 E287 D288 I292 Y298	V286-R290 WeakPolarHBondContact O-CB 3.49Å; V286-R290 PolarHBondContact O-N 3.44Å; E287-R290 PolarHBondContact O-N 3.44Å; D288-R290 VanDerWaalsContact C-N 3.33Å; D288-R290 PolarHBondContact O-N 3.46Å; R290-I292 PolarHBondContact O-N 3.42Å; R290-Y298 HydrophobicContact CB-CD2 4.07Å; R290-Y298 HydrophobicContact CB-CE2 4.46Å; R290-Y298 HydrophobicContact CB-CG 4.3Å; R290-Y298 HydrophobicContact CG-CD1 4.41Å; R290-Y298 HydrophobicContact CG-CD2 4.36Å; R290-Y298 HydrophobicContact CG-CE2 4.5Å; R290-Y298 HydrophobicContact CG-CG 4.32Å
291	S	82.5	Confident	82	Confident	92 Å²	92	59.1 Å²	59.1	64%	0.643	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.4	176.6	81.3	0	0	0	0	114.1	E287 D288 I289 P293	E287-S291 PolarHBondContact O-N 2.86Å; D288-S291 WeakPolarHBondContact O-CB 3.3Å; D288-S291 PolarHBondContact O-N 3.37Å; D288-S291 VanDerWaalsContact O-N 3.15Å; D288-S291 PolarHBondContact O-OG 2.97Å; I289-S291 PolarHBondContact O-N 3.5Å; S291-P293 WeakPolarHBondContact O-CD 3.33Å
292	I	80.4	Confident	81.8	Confident	70 Å²	70	60.6 Å²	60.6	36%	0.359	33%	0.325	S	S	.	.	S	Bend	trans	-78.9	121	-179.4	-56.4	174	0	0	0	109.8	L244 I289 R290 N295	L244-I292 HydrophobicContact CD2-CD1 3.78Å; I289-I292 WeakPolarHBondContact O-CB 3.35Å; I289-I292 PolarHBondContact O-N 2.88Å; I289-I292 VanDerWaalsContact O-N 3.14Å; R290-I292 PolarHBondContact O-N 3.42Å; I292-N295 HydrophobicContact CB-CB 3.92Å; I292-N295 HydrophobicContact CG2-CB 3.94Å; I292-N295 WeakPolarHBondContact O-CB 3.15Å; I292-N295 PolarHBondContact O-N 3.19Å
293	P	65.3	Low	81.7	Confident	115 Å²	115	60.6 Å²	60.6	75%	0.747	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	140.6	178.9	-20.2	30.7	0	0	0	112.6	S291 N295	S291-P293 WeakPolarHBondContact O-CD 3.33Å; P293-N295 PolarHBondContact O-N 2.91Å
294	N	62.5	Low	81.7	Confident	173 Å²	173	61.7 Å²	61.7	93%	0.925	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	17.5	178.6	-64.6	-19.2	0	0	0	115.8	K296	N294-K296 PolarHBondContact O-N 3Å
295	N	69.4	Low	81.6	Confident	33 Å²	33	61.8 Å²	61.8	18%	0.176	32%	0.324	C	S	.	.			trans	-87.9	108	-179.6	-166.7	-5.9	0	0	0	112.2	I292 P293 I297	I292-N295 HydrophobicContact CB-CB 3.92Å; I292-N295 HydrophobicContact CG2-CB 3.94Å; I292-N295 WeakPolarHBondContact O-CB 3.15Å; I292-N295 PolarHBondContact O-N 3.19Å; P293-N295 PolarHBondContact O-N 2.91Å; N295-I297 VanDerWaalsContact C-N 3.27Å; N295-I297 PolarHBondContact O-N 3.22Å; N295-I297 WeakPolarHBondContact OD1-CB 3.36Å; N295-I297 WeakPolarHBondContact OD1-CD1 3.42Å; N295-I297 WeakPolarHBondContact OD1-CG1 3.37Å; N295-I297 PolarHBondContact OD1-N 3.43Å
296	K	75.3	Confident	81.5	Confident	160 Å²	160	62.4 Å²	62.4	70%	0.696	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-79.2	-1.9	176.9	-63.3	-171.1	177.4	-173.3	0	114.2	N294 Y298 E299	N294-K296 PolarHBondContact O-N 3Å; K296-Y298 VanDerWaalsContact C-N 3.32Å; K296-Y298 PolarHBondContact O-N 2.91Å; K296-E299 WeakPolarHBondContact O-CB 3.48Å; K296-E299 PolarHBondContact O-N 2.92Å
297	I	82.3	Confident	81.5	Confident	21 Å²	21	62.8 Å²	62.8	11%	0.108	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.7	-39.9	-177.9	-67.5	168.8	0	0	0	111.2	L244 V246 V249 I289 N295 E299 S300 I303	L244-I297 HydrophobicContact CD1-CD1 4.42Å; L244-I297 HydrophobicContact CD2-CD1 4.36Å; L244-I297 HydrophobicContact CG-CD1 3.76Å; V246-I297 HydrophobicContact CG2-CB 4.47Å; V246-I297 HydrophobicContact CG2-CG1 4.29Å; V246-I297 HydrophobicContact CG2-CG2 4.14Å; V249-I297 HydrophobicContact CG2-CG2 4.19Å; I289-I297 HydrophobicContact CG2-CB 4.41Å; I289-I297 HydrophobicContact CG2-CG2 4.35Å; N295-I297 VanDerWaalsContact C-N 3.27Å; N295-I297 PolarHBondContact O-N 3.22Å; N295-I297 WeakPolarHBondContact OD1-CB 3.36Å; N295-I297 WeakPolarHBondContact OD1-CD1 3.42Å; N295-I297 WeakPolarHBondContact OD1-CG1 3.37Å; N295-I297 PolarHBondContact OD1-N 3.43Å; I297-E299 PolarHBondContact O-N 3.44Å; I297-S300 VanDerWaalsContact O-CB 3.32Å; I297-S300 WeakPolarHBondContact O-CB 3.27Å; I297-S300 PolarHBondContact O-N 3.13Å; I297-S300 VanDerWaalsContact O-N 3.15Å; I297-I303 HydrophobicContact CG2-CD1 3.47Å; I297-I303 VanDerWaalsContact CG2-CD1 3.47Å; I297-I303 WeakPolarHBondContact O-CD1 3.4Å
298	Y	83.4	Confident	81.4	Confident	26 Å²	26	60 Å²	60	10%	0.102	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29	178.2	172.8	-95.5	0	0	0	113.1	V286 R290 K296 S300 Q304 Y307	V286-Y298 HydrophobicContact CG1-CD2 3.56Å; V286-Y298 HydrophobicContact CG1-CE2 3.52Å; R290-Y298 HydrophobicContact CB-CD2 4.07Å; R290-Y298 HydrophobicContact CB-CE2 4.46Å; R290-Y298 HydrophobicContact CB-CG 4.3Å; R290-Y298 HydrophobicContact CG-CD1 4.41Å; R290-Y298 HydrophobicContact CG-CD2 4.36Å; R290-Y298 HydrophobicContact CG-CE2 4.5Å; R290-Y298 HydrophobicContact CG-CG 4.32Å; K296-Y298 VanDerWaalsContact C-N 3.32Å; K296-Y298 PolarHBondContact O-N 2.91Å; Y298-S300 PolarHBondContact O-N 3.47Å; Y298-Q304 VanDerWaalsContact O-CG 3.27Å; Y298-Q304 WeakPolarHBondContact O-CG 3.39Å; Y298-Y307 HydrophobicContact CE2-CD1 4.44Å
299	E	82.1	Confident	81.4	Confident	123 Å²	123	59 Å²	59	58%	0.575	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-73.7	-6.5	-179	-59.1	175.6	172.8	0	0	112.7	K296 I297 P301	K296-E299 WeakPolarHBondContact O-CB 3.48Å; K296-E299 PolarHBondContact O-N 2.92Å; I297-E299 PolarHBondContact O-N 3.44Å; E299-P301 WeakPolarHBondContact O-CD 3.23Å
300	S	85.5	Confident	81.4	Confident	24 Å²	24	58.7 Å²	58.7	17%	0.168	31%	0.307	C	S	.	.			trans	-65.6	126.1	176.6	178.2	0	0	0	0	111.4	V246 I297 Y298 A302 I303 Q304	V246-S300 WeakPolarHBondContact CG1-OG 3.33Å; I297-S300 VanDerWaalsContact O-CB 3.32Å; I297-S300 WeakPolarHBondContact O-CB 3.27Å; I297-S300 PolarHBondContact O-N 3.13Å; I297-S300 VanDerWaalsContact O-N 3.15Å; Y298-S300 PolarHBondContact O-N 3.47Å; S300-A302 PolarHBondContact O-N 2.87Å; S300-A302 VanDerWaalsContact O-N 3.13Å; S300-I303 PolarHBondContact O-N 3.49Å; S300-Q304 PolarHBondContact O-N 3.48Å; S300-Q304 VanDerWaalsContact O-N 3.14Å
301	P	82.5	Confident	81.5	Confident	49 Å²	49	52 Å²	52	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-54.3	-36.6	179.8	-27.7	34.3	0	0	0	113.4	E299 I303 Q304 F305 F341	E299-P301 WeakPolarHBondContact O-CD 3.23Å; P301-I303 VanDerWaalsContact C-N 3.35Å; P301-I303 PolarHBondContact O-N 2.88Å; P301-Q304 PolarHBondContact O-N 3.03Å; P301-F305 WeakPolarHBondContact O-CB 3.37Å; P301-F305 PolarHBondContact O-N 3.3Å; P301-F341 HydrophobicContact CB-CE2 4.28Å; P301-F341 HydrophobicContact CB-CZ 3.8Å; P301-F341 WeakPolarHBondContact O-CZ 3.28Å
302	A	81.2	Confident	81.7	Confident	42 Å²	42	47.9 Å²	47.9	35%	0.347	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-37.5	179.7	0	0	0	0	0	112.8	V250 S300 N306	V250-A302 HydrophobicContact CG2-CB 3.91Å; S300-A302 PolarHBondContact O-N 2.87Å; S300-A302 VanDerWaalsContact O-N 3.13Å; A302-N306 PolarHBondContact O-N 2.76Å; A302-N306 PolarHBondContact O-ND2 3.42Å
303	I	85.4	Confident	81.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.8	-44.9	178.3	-69.5	172.6	0	0	0	109.5	V246 V249 V250 L253 V286 I297 S300 P301 F305 N306 Y307	V246-I303 HydrophobicContact CG1-CD1 4.23Å; V249-I303 HydrophobicContact CB-CD1 3.93Å; V249-I303 HydrophobicContact CG1-CD1 3.64Å; V249-I303 HydrophobicContact CG1-CG1 4.05Å; V250-I303 HydrophobicContact CG2-CD1 4.28Å; V250-I303 HydrophobicContact CG2-CG1 3.57Å; L253-I303 HydrophobicContact CD1-CB 4.49Å; L253-I303 HydrophobicContact CD1-CG1 4.38Å; L253-I303 HydrophobicContact CD1-CG2 4.11Å; V286-I303 HydrophobicContact CG1-CG2 4.19Å; V286-I303 HydrophobicContact CG2-CG2 4.18Å; I297-I303 HydrophobicContact CG2-CD1 3.47Å; I297-I303 VanDerWaalsContact CG2-CD1 3.47Å; I297-I303 WeakPolarHBondContact O-CD1 3.4Å; S300-I303 PolarHBondContact O-N 3.49Å; P301-I303 VanDerWaalsContact C-N 3.35Å; P301-I303 PolarHBondContact O-N 2.88Å; I303-F305 VanDerWaalsContact C-N 3.34Å; I303-F305 PolarHBondContact O-N 3.42Å; I303-N306 PolarHBondContact O-N 3.4Å; I303-Y307 VanDerWaalsContact O-CB 3.27Å; I303-Y307 WeakPolarHBondContact O-CB 3.42Å; I303-Y307 PolarHBondContact O-N 2.83Å
304	Q	87.8	Confident	82.5	Confident	26 Å²	26	46.6 Å²	46.6	12%	0.121	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-39.4	178.6	-64.1	179.3	-29	0	0	112.5	Y298 S300 P301 Y307 A308 I330	Y298-Q304 VanDerWaalsContact O-CG 3.27Å; Y298-Q304 WeakPolarHBondContact O-CG 3.39Å; S300-Q304 PolarHBondContact O-N 3.48Å; S300-Q304 VanDerWaalsContact O-N 3.14Å; P301-Q304 PolarHBondContact O-N 3.03Å; Q304-Y307 PolarHBondContact O-N 2.97Å; Q304-A308 WeakPolarHBondContact O-CB 3.39Å; Q304-A308 PolarHBondContact O-N 3.24Å; Q304-I330 HydrophobicContact CB-CD1 3.57Å; Q304-I330 HydrophobicContact CG-CD1 4.3Å; Q304-I330 VanDerWaalsContact OE1-CD1 3.24Å
305	F	86.6	Confident	83.5	Confident	50 Å²	50	41.7 Å²	41.7	22%	0.219	20%	0.201	C	C	.	.	H	α-helix	trans	-58.2	-53.5	173.3	179	-92.3	0	0	0	112.1	P301 I303 Y307 A308 F309 D340 F341 L344	P301-F305 WeakPolarHBondContact O-CB 3.37Å; P301-F305 PolarHBondContact O-N 3.3Å; I303-F305 VanDerWaalsContact C-N 3.34Å; I303-F305 PolarHBondContact O-N 3.42Å; F305-Y307 VanDerWaalsContact C-N 3.27Å; F305-Y307 PolarHBondContact O-N 3.41Å; F305-A308 PolarHBondContact O-N 3.25Å; F305-F309 WeakPolarHBondContact O-CB 3.35Å; F305-F309 PolarHBondContact O-N 3.39Å; F305-D340 HydrophobicContact CD2-CB 4.47Å; F305-D340 HydrophobicContact CE2-CB 3.83Å; F305-D340 HydrophobicContact CZ-CB 4.26Å; F305-F341 HydrophobicContact CB-CD1 4.47Å; F305-F341 HydrophobicContact CB-CE1 3.65Å; F305-F341 HydrophobicContact CB-CZ 3.92Å; F305-F341 AromaticContact CD2-CD1 3.94Å; F305-F341 HydrophobicContact CD2-CD1 3.94Å; F305-F341 AromaticContact CD2-CE1 3.93Å; F305-F341 HydrophobicContact CD2-CE1 3.93Å; F305-F341 HydrophobicContact CD2-CG 4.42Å; F305-F341 HydrophobicContact CD2-CZ 4.4Å; F305-F341 HydrophobicContact CG-CE1 4.3Å; F305-L344 HydrophobicContact CD2-CD2 3.64Å; F305-L344 HydrophobicContact CE2-CB 3.91Å; F305-L344 HydrophobicContact CE2-CD2 3.56Å; F305-L344 HydrophobicContact CE2-CG 4.33Å; F305-L344 HydrophobicContact CG-CD2 4.32Å; F305-L344 HydrophobicContact CZ-CD2 4.18Å
306	N	84.8	Confident	84.1	Confident	20 Å²	20	44.4 Å²	44.4	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-34.6	-179.1	-79.8	-78.9	0	0	0	111.9	L253 M282 A302 I303 A310	L253-N306 HydrophobicContact CB-CB 4.3Å; L253-N306 HydrophobicContact CD1-CB 3.99Å; M282-N306 HydrophobicContact CE-CB 4.16Å; A302-N306 PolarHBondContact O-N 2.76Å; A302-N306 PolarHBondContact O-ND2 3.42Å; I303-N306 PolarHBondContact O-N 3.4Å; N306-A310 WeakPolarHBondContact O-CB 3.27Å; N306-A310 PolarHBondContact O-N 2.88Å
307	Y	89	Confident	84.2	Confident	8 Å²	8	43.7 Å²	43.7	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-49.1	176	175.7	-117.5	0	0	0	112.3	V283 V286 E287 Y298 I303 Q304 F305 F309 A310 L311 L326	V283-Y307 HydrophobicContact CB-CE2 4.42Å; V283-Y307 HydrophobicContact CG1-CE2 4.07Å; V283-Y307 HydrophobicContact CG2-CD2 4.49Å; V283-Y307 HydrophobicContact CG2-CE2 4.39Å; V286-Y307 HydrophobicContact CB-CD2 3.55Å; V286-Y307 HydrophobicContact CB-CE2 4.07Å; V286-Y307 HydrophobicContact CB-CG 4.07Å; V286-Y307 HydrophobicContact CG1-CD1 4.16Å; V286-Y307 HydrophobicContact CG1-CD2 3.58Å; V286-Y307 HydrophobicContact CG1-CE2 4.07Å; V286-Y307 HydrophobicContact CG1-CG 3.63Å; V286-Y307 HydrophobicContact CG2-CD2 3.99Å; V286-Y307 HydrophobicContact CG2-CG 4.32Å; E287-Y307 HydrophobicContact CG-CE2 4.32Å; E287-Y307 PolarHBondContact OE1-OH 3.18Å; Y298-Y307 HydrophobicContact CE2-CD1 4.44Å; I303-Y307 VanDerWaalsContact O-CB 3.27Å; I303-Y307 WeakPolarHBondContact O-CB 3.42Å; I303-Y307 PolarHBondContact O-N 2.83Å; Q304-Y307 PolarHBondContact O-N 2.97Å; F305-Y307 VanDerWaalsContact C-N 3.27Å; F305-Y307 PolarHBondContact O-N 3.41Å; Y307-F309 VanDerWaalsContact C-N 3.3Å; Y307-F309 PolarHBondContact O-N 3.22Å; Y307-A310 PolarHBondContact O-N 3.42Å; Y307-A310 VanDerWaalsContact O-N 3.16Å; Y307-L311 HydrophobicContact CD1-CD1 4.17Å; Y307-L311 HydrophobicContact CD2-CG 4.44Å; Y307-L311 HydrophobicContact CE1-CD1 3.61Å; Y307-L311 HydrophobicContact CE1-CG 4.47Å; Y307-L311 HydrophobicContact CE2-CD1 4.09Å; Y307-L311 HydrophobicContact CE2-CD2 4.35Å; Y307-L311 HydrophobicContact CE2-CG 4.11Å; Y307-L311 WeakPolarHBondContact O-CG 3.5Å; Y307-L311 PolarHBondContact O-N 3.31Å; Y307-L326 HydrophobicContact CD1-CD2 3.36Å; Y307-L326 HydrophobicContact CE1-CD2 3.75Å
308	A	87.5	Confident	84.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-41.6	174.8	0	0	0	0	0	112	Q304 F305 L311 N312 A323 L326 I327 L344	Q304-A308 WeakPolarHBondContact O-CB 3.39Å; Q304-A308 PolarHBondContact O-N 3.24Å; F305-A308 PolarHBondContact O-N 3.25Å; A308-L311 PolarHBondContact O-N 3.46Å; A308-N312 PolarHBondContact O-N 3.49Å; A308-A323 WeakPolarHBondContact O-CB 3.38Å; A308-L326 HydrophobicContact CB-CD2 4.13Å; A308-I327 HydrophobicContact CB-CD1 3.58Å; A308-I327 HydrophobicContact CB-CG1 3.48Å; A308-I327 VanDerWaalsContact CB-CG1 3.48Å; A308-L344 HydrophobicContact CB-CD2 4.1Å
309	F	85.6	Confident	84.4	Confident	60 Å²	60	46.9 Å²	46.9	26%	0.263	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-46.5	174.2	-179.5	-95.6	0	0	0	111.7	Y279 F305 Y307 N312 R313 L344	Y279-F309 HydrophobicContact CE1-CD1 4.41Å; Y279-F309 AromaticContact CE1-CE1 3.98Å; Y279-F309 HydrophobicContact CE1-CE1 3.98Å; F305-F309 WeakPolarHBondContact O-CB 3.35Å; F305-F309 PolarHBondContact O-N 3.39Å; Y307-F309 VanDerWaalsContact C-N 3.3Å; Y307-F309 PolarHBondContact O-N 3.22Å; F309-N312 PolarHBondContact O-N 3.44Å; F309-R313 HydrophobicContact CD1-CG 4.31Å; F309-R313 HydrophobicContact CE1-CG 3.93Å; F309-R313 HydrophobicContact CE2-CG 4.36Å; F309-R313 HydrophobicContact CZ-CG 3.96Å; F309-R313 VanDerWaalsContact O-CG 3.31Å; F309-R313 WeakPolarHBondContact O-CG 3.38Å; F309-R313 PolarHBondContact O-N 3.39Å; F309-R313 VanDerWaalsContact O-N 3.1Å; F309-L344 HydrophobicContact CB-CD1 4.37Å; F309-L344 HydrophobicContact CB-CD2 4.35Å; F309-L344 HydrophobicContact CD2-CD1 4Å
310	A	85.2	Confident	84.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-42.3	178.6	0	0	0	0	0	112.6	Y279 M282 V283 N306 Y307 R313 R314	Y279-A310 HydrophobicContact CD1-CB 4.07Å; M282-A310 HydrophobicContact CB-CB 3.85Å; M282-A310 HydrophobicContact CE-CB 3.92Å; M282-A310 HydrophobicContact SD-CB 3.93Å; V283-A310 HydrophobicContact CG2-CB 4.03Å; N306-A310 WeakPolarHBondContact O-CB 3.27Å; N306-A310 PolarHBondContact O-N 2.88Å; Y307-A310 PolarHBondContact O-N 3.42Å; Y307-A310 VanDerWaalsContact O-N 3.16Å; A310-R313 PolarHBondContact O-N 3.3Å; A310-R314 WeakPolarHBondContact O-CB 3.46Å; A310-R314 PolarHBondContact O-N 2.93Å
311	L	87.6	Confident	84.7	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-51.2	174.2	-76.3	173.6	0	0	0	111.3	V283 Y307 A308 R313 R314 N315 D319 R322 A323	V283-L311 HydrophobicContact CG1-CD2 4.02Å; V283-L311 HydrophobicContact CG2-CD2 3.81Å; V283-L311 HydrophobicContact CG2-CG 4.1Å; Y307-L311 HydrophobicContact CD1-CD1 4.17Å; Y307-L311 HydrophobicContact CD2-CG 4.44Å; Y307-L311 HydrophobicContact CE1-CD1 3.61Å; Y307-L311 HydrophobicContact CE1-CG 4.47Å; Y307-L311 HydrophobicContact CE2-CD1 4.09Å; Y307-L311 HydrophobicContact CE2-CD2 4.35Å; Y307-L311 HydrophobicContact CE2-CG 4.11Å; Y307-L311 WeakPolarHBondContact O-CG 3.5Å; Y307-L311 PolarHBondContact O-N 3.31Å; A308-L311 PolarHBondContact O-N 3.46Å; L311-R313 PolarHBondContact O-N 3.45Å; L311-R314 PolarHBondContact O-N 3.22Å; L311-N315 PolarHBondContact O-N 2.98Å; L311-D319 HydrophobicContact CB-CB 4.25Å; L311-D319 HydrophobicContact CD2-CB 4.13Å; L311-D319 WeakPolarHBondContact CD2-OD1 3.39Å; L311-D319 VanDerWaalsContact O-CB 3.31Å; L311-D319 WeakPolarHBondContact O-CB 3.24Å; L311-R322 HydrophobicContact CD1-CB 4.23Å; L311-A323 HydrophobicContact CB-CB 3.79Å; L311-A323 HydrophobicContact CD1-CB 4.34Å
312	N	85.5	Confident	85.1	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-35	179.4	-178.8	52.6	0	0	0	112.8	A308 F309 R320 A323 I348 D351	A308-N312 PolarHBondContact O-N 3.49Å; F309-N312 PolarHBondContact O-N 3.44Å; N312-R320 PolarHBondContact OD1-NE 2.91Å; N312-A323 HydrophobicContact CB-CB 4.32Å; N312-I348 HydrophobicContact CB-CG1 3.93Å; N312-D351 PolarHBondContact ND2-OD2 2.89Å
313	R	81.1	Confident	85.5	Confident	89 Å²	89	43.1 Å²	43.1	34%	0.336	21%	0.207	S	C	.	.	H	α-helix	trans	-78.4	-33	178.9	-64.7	-66.6	-78.5	169.9	-3.1	113.2	Y279 F309 A310 L311	Y279-R313 HydrophobicContact CD1-CB 4.06Å; Y279-R313 HydrophobicContact CD2-CB 3.86Å; Y279-R313 HydrophobicContact CE1-CB 3.94Å; Y279-R313 HydrophobicContact CE1-CG 4.13Å; Y279-R313 HydrophobicContact CE2-CB 3.75Å; Y279-R313 HydrophobicContact CE2-CG 4.46Å; Y279-R313 HydrophobicContact CG-CB 4.02Å; F309-R313 HydrophobicContact CD1-CG 4.31Å; F309-R313 HydrophobicContact CE1-CG 3.93Å; F309-R313 HydrophobicContact CE2-CG 4.36Å; F309-R313 HydrophobicContact CZ-CG 3.96Å; F309-R313 VanDerWaalsContact O-CG 3.31Å; F309-R313 WeakPolarHBondContact O-CG 3.38Å; F309-R313 PolarHBondContact O-N 3.39Å; F309-R313 VanDerWaalsContact O-N 3.1Å; A310-R313 PolarHBondContact O-N 3.3Å; L311-R313 PolarHBondContact O-N 3.45Å
314	R	82.8	Confident	85.7	Confident	69 Å²	69	43.9 Å²	43.9	26%	0.26	21%	0.211	S	C	.	.	H	α-helix	trans	-70.9	-45.5	176.6	-170.4	178.3	72.9	166.4	4.2	111.2	A310 L311 I316 D319	A310-R314 WeakPolarHBondContact O-CB 3.46Å; A310-R314 PolarHBondContact O-N 2.93Å; L311-R314 PolarHBondContact O-N 3.22Å; R314-I316 HydrophobicContact CG-CB 4.5Å; R314-I316 HydrophobicContact CG-CD1 3.81Å; R314-I316 HydrophobicContact CG-CG1 4.08Å; R314-I316 PolarHBondContact O-N 3.04Å; R314-D319 IonicContact CZ-OD1 2.67Å; R314-D319 IonicContact CZ-OD2 3.11Å; R314-D319 IonicContact NE-OD1 2.89Å; R314-D319 IonicContact NE-OD2 3.52Å; R314-D319 PolarHBondContact NE-OD2 3.37Å; R314-D319 VanDerWaalsContact NH2-CG 3.31Å; R314-D319 IonicContact NH2-OD1 3.14Å; R314-D319 PolarHBondContact NH2-OD1 2.94Å; R314-D319 IonicContact NH2-OD2 2.64Å; R314-D319 PolarHBondContact NH2-OD2 3.4Å; R314-D319 VanDerWaalsContact NH2-OD2 3.12Å
315	N	82.6	Confident	85.9	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.374	24%	0.237	S	C	.	.			trans	50.1	47.3	174.3	-163.4	38	0	0	0	114.6	L311 R320 D355	L311-N315 PolarHBondContact O-N 2.98Å; N315-R320 PolarHBondContact ND2-NH2 2.96Å; N315-D355 PolarHBondContact ND2-OD2 2.76Å
316	I	82.3	Confident	86	Confident	91 Å²	91	48.1 Å²	48.1	47%	0.467	23%	0.232	S	C	.	.			trans	-113.8	143	174.8	-60.6	170.7	0	0	0	108.3	R314 D318 D319	R314-I316 HydrophobicContact CG-CB 4.5Å; R314-I316 HydrophobicContact CG-CD1 3.81Å; R314-I316 HydrophobicContact CG-CG1 4.08Å; R314-I316 PolarHBondContact O-N 3.04Å; I316-D318 PolarHBondContact O-N 2.85Å; I316-D319 PolarHBondContact N-OD2 3.45Å; I316-D319 WeakPolarHBondContact O-CB 3.28Å; I316-D319 PolarHBondContact O-N 3.32Å; I316-D319 VanDerWaalsContact O-N 3.08Å; I316-D319 VanDerWaalsContact O-OD2 3.08Å
317	D	76.8	Confident	86.2	Confident	144 Å²	144	47.1 Å²	47.1	77%	0.77	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	55	173.3	-57	-32.3	0	0	0	114.9	D319	D317-D319 PolarHBondContact O-N 3.3Å
318	D	82.2	Confident	86.2	Confident	115 Å²	115	49.2 Å²	49.2	62%	0.615	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	23.4	178.3	-157.5	30.6	0	0	0	115.5	I316 R320 A321 R322	I316-D318 PolarHBondContact O-N 2.85Å; D318-R320 PolarHBondContact O-N 2.91Å; D318-A321 VanDerWaalsContact CG-CB 3.45Å; D318-A321 PolarHBondContact O-N 2.52Å; D318-A321 VanDerWaalsContact O-N 3.11Å; D318-A321 WeakPolarHBondContact OD1-CB 3.4Å; D318-A321 WeakPolarHBondContact OD2-CB 3.44Å; D318-R322 PolarHBondContact O-N 3.46Å
319	D	87.5	Confident	86.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-48.1	-35.4	172.9	-80.4	-18	0	0	0	113.6	L311 R314 I316 D317 R322 A323	L311-D319 HydrophobicContact CB-CB 4.25Å; L311-D319 HydrophobicContact CD2-CB 4.13Å; L311-D319 WeakPolarHBondContact CD2-OD1 3.39Å; L311-D319 VanDerWaalsContact O-CB 3.31Å; L311-D319 WeakPolarHBondContact O-CB 3.24Å; R314-D319 IonicContact CZ-OD1 2.67Å; R314-D319 IonicContact CZ-OD2 3.11Å; R314-D319 IonicContact NE-OD1 2.89Å; R314-D319 IonicContact NE-OD2 3.52Å; R314-D319 PolarHBondContact NE-OD2 3.37Å; R314-D319 VanDerWaalsContact NH2-CG 3.31Å; R314-D319 IonicContact NH2-OD1 3.14Å; R314-D319 PolarHBondContact NH2-OD1 2.94Å; R314-D319 IonicContact NH2-OD2 2.64Å; R314-D319 PolarHBondContact NH2-OD2 3.4Å; R314-D319 VanDerWaalsContact NH2-OD2 3.12Å; I316-D319 PolarHBondContact N-OD2 3.45Å; I316-D319 WeakPolarHBondContact O-CB 3.28Å; I316-D319 PolarHBondContact O-N 3.32Å; I316-D319 VanDerWaalsContact O-N 3.08Å; I316-D319 VanDerWaalsContact O-OD2 3.08Å; D317-D319 PolarHBondContact O-N 3.3Å; D319-R322 PolarHBondContact O-N 3.27Å; D319-R322 IonicContact OD1-CZ 3.5Å; D319-R322 IonicContact OD1-NE 3.9Å; D319-R322 IonicContact OD1-NH2 3.98Å; D319-R322 PolarHBondContact OD1-NH2 3.38Å; D319-A323 WeakPolarHBondContact O-CB 3.39Å; D319-A323 PolarHBondContact O-N 3.13Å
320	R	87.6	Confident	86.1	Confident	32 Å²	32	51.1 Å²	51.1	12%	0.121	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-39.5	-177.5	-168.4	174.5	-69.1	141.3	-2.3	112.5	N312 N315 D318 R322 A323 L324 I348 D355	N312-R320 PolarHBondContact OD1-NE 2.91Å; N315-R320 PolarHBondContact ND2-NH2 2.96Å; D318-R320 PolarHBondContact O-N 2.91Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R320-A323 PolarHBondContact O-N 3.16Å; R320-L324 WeakPolarHBondContact O-CB 3.37Å; R320-L324 PolarHBondContact O-N 3.03Å; R320-I348 HydrophobicContact CG-CG2 3.59Å; R320-D355 IonicContact CZ-OD2 2.81Å; R320-D355 IonicContact NH1-OD2 3.32Å; R320-D355 PolarHBondContact NH1-OD2 2.97Å; R320-D355 IonicContact NH2-OD2 3.14Å; R320-D355 PolarHBondContact NH2-OD2 3.16Å
321	A	87.9	Confident	86.1	Confident	34 Å²	34	51.9 Å²	51.9	28%	0.281	26%	0.255	S	S	.	.	H	α-helix	trans	-65.6	-41	174.9	0	0	0	0	0	110.8	D318 L324 E325	D318-A321 VanDerWaalsContact CG-CB 3.45Å; D318-A321 PolarHBondContact O-N 2.52Å; D318-A321 VanDerWaalsContact O-N 3.11Å; D318-A321 WeakPolarHBondContact OD1-CB 3.4Å; D318-A321 WeakPolarHBondContact OD2-CB 3.44Å; A321-L324 PolarHBondContact O-N 3.49Å; A321-E325 WeakPolarHBondContact O-CB 3.37Å; A321-E325 PolarHBondContact O-N 3.08Å
322	R	89.4	Confident	85.9	Confident	92 Å²	92	59.3 Å²	59.3	35%	0.347	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-43.7	174.9	-66	-166.7	-72.7	164.2	-14	112.8	E287 L311 D318 D319 R320 L324 E325 L326	E287-R322 IonicContact OE1-NH1 3.26Å; L311-R322 HydrophobicContact CD1-CB 4.23Å; D318-R322 PolarHBondContact O-N 3.46Å; D319-R322 PolarHBondContact O-N 3.27Å; D319-R322 IonicContact OD1-CZ 3.5Å; D319-R322 IonicContact OD1-NE 3.9Å; D319-R322 IonicContact OD1-NH2 3.98Å; D319-R322 PolarHBondContact OD1-NH2 3.38Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 3.27Å; R322-E325 PolarHBondContact O-N 3.12Å; R322-L326 WeakPolarHBondContact O-CB 3.35Å; R322-L326 PolarHBondContact O-N 2.86Å
323	A	90.2	Very high	85.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-42.3	175.2	0	0	0	0	0	111.3	A308 L311 N312 D319 R320 I327 I348	A308-A323 WeakPolarHBondContact O-CB 3.38Å; L311-A323 HydrophobicContact CB-CB 3.79Å; L311-A323 HydrophobicContact CD1-CB 4.34Å; N312-A323 HydrophobicContact CB-CB 4.32Å; D319-A323 WeakPolarHBondContact O-CB 3.39Å; D319-A323 PolarHBondContact O-N 3.13Å; R320-A323 PolarHBondContact O-N 3.16Å; A323-I327 VanDerWaalsContact O-CG1 3.28Å; A323-I327 WeakPolarHBondContact O-CG1 3.44Å; A323-I327 PolarHBondContact O-N 3.44Å; A323-I327 VanDerWaalsContact O-N 3.14Å; A323-I348 HydrophobicContact CB-CD1 3.99Å
324	L	90.8	Very high	84.6	Confident	16 Å²	16	65.1 Å²	65.1	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-47.7	179.7	-176.7	60.8	0	0	0	111.9	R320 A321 R322 L326 I327 L328 I348 Y349	R320-L324 WeakPolarHBondContact O-CB 3.37Å; R320-L324 PolarHBondContact O-N 3.03Å; A321-L324 PolarHBondContact O-N 3.49Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 3.27Å; L324-L326 VanDerWaalsContact C-N 3.32Å; L324-L326 PolarHBondContact O-N 3.49Å; L324-I327 PolarHBondContact O-N 3.4Å; L324-L328 HydrophobicContact CD1-CD1 3.97Å; L324-L328 HydrophobicContact CD1-CG 4.01Å; L324-L328 HydrophobicContact CG-CD1 3.86Å; L324-L328 HydrophobicContact CG-CG 4.29Å; L324-L328 WeakPolarHBondContact O-CB 3.47Å; L324-L328 VanDerWaalsContact O-CG 3.25Å; L324-L328 WeakPolarHBondContact O-CG 2.98Å; L324-L328 PolarHBondContact O-N 2.86Å; L324-I348 HydrophobicContact CB-CG2 3.98Å; L324-I348 HydrophobicContact CD1-CG2 4.18Å; L324-Y349 HydrophobicContact CD1-CD2 3.98Å; L324-Y349 HydrophobicContact CD1-CE1 4.37Å; L324-Y349 HydrophobicContact CD1-CE2 3.41Å; L324-Y349 VanDerWaalsContact CD1-CE2 3.41Å; L324-Y349 HydrophobicContact CD2-CD1 4.42Å; L324-Y349 HydrophobicContact CD2-CE1 3.69Å; L324-Y349 HydrophobicContact CD2-CE2 4.24Å; L324-Y349 HydrophobicContact CG-CE2 4.41Å
325	E	90.1	Very high	83.9	Confident	143 Å²	143	69.2 Å²	69.2	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-56.6	-47.1	177.6	-176.1	179.3	-170.3	0	0	111.1	A321 R322 I327 L328 D329	A321-E325 WeakPolarHBondContact O-CB 3.37Å; A321-E325 PolarHBondContact O-N 3.08Å; R322-E325 PolarHBondContact O-N 3.12Å; E325-I327 PolarHBondContact O-N 2.77Å; E325-L328 PolarHBondContact O-N 3.34Å; E325-D329 WeakPolarHBondContact O-CB 3.49Å; E325-D329 PolarHBondContact O-N 3.07Å
326	L	89.3	Confident	83.1	Confident	22 Å²	22	67.6 Å²	67.6	12%	0.115	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-47.5	177.8	179	66.3	0	0	0	112.4	Y307 A308 R322 L324 D329 I330	Y307-L326 HydrophobicContact CD1-CD2 3.36Å; Y307-L326 HydrophobicContact CE1-CD2 3.75Å; A308-L326 HydrophobicContact CB-CD2 4.13Å; R322-L326 WeakPolarHBondContact O-CB 3.35Å; R322-L326 PolarHBondContact O-N 2.86Å; L324-L326 VanDerWaalsContact C-N 3.32Å; L324-L326 PolarHBondContact O-N 3.49Å; L326-D329 PolarHBondContact O-N 2.94Å; L326-I330 HydrophobicContact CD1-CD1 4.24Å; L326-I330 HydrophobicContact CG-CD1 4.05Å; L326-I330 WeakPolarHBondContact O-CD1 3.45Å; L326-I330 VanDerWaalsContact O-CG1 3.27Å; L326-I330 WeakPolarHBondContact O-CG1 3.43Å; L326-I330 PolarHBondContact O-N 2.9Å; L326-I330 VanDerWaalsContact O-N 3.09Å
327	I	89.1	Confident	82.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-67.7	-41	-178.5	-70	-69.7	0	0	0	111.4	A308 A323 L324 E325 D329 I330 L331 F341 L344 A345 I348	A308-I327 HydrophobicContact CB-CD1 3.58Å; A308-I327 HydrophobicContact CB-CG1 3.48Å; A308-I327 VanDerWaalsContact CB-CG1 3.48Å; A323-I327 VanDerWaalsContact O-CG1 3.28Å; A323-I327 WeakPolarHBondContact O-CG1 3.44Å; A323-I327 PolarHBondContact O-N 3.44Å; A323-I327 VanDerWaalsContact O-N 3.14Å; L324-I327 PolarHBondContact O-N 3.4Å; E325-I327 PolarHBondContact O-N 2.77Å; I327-D329 VanDerWaalsContact C-N 3.29Å; I327-D329 PolarHBondContact O-N 2.96Å; I327-I330 HydrophobicContact CD1-CD1 4.48Å; I327-I330 PolarHBondContact O-N 3.25Å; I327-L331 HydrophobicContact CG2-CD1 3.72Å; I327-L331 HydrophobicContact CG2-CG 4.41Å; I327-L331 WeakPolarHBondContact O-CB 3.3Å; I327-L331 VanDerWaalsContact O-CG 3.28Å; I327-L331 WeakPolarHBondContact O-CG 3.49Å; I327-L331 PolarHBondContact O-N 3.41Å; I327-F341 HydrophobicContact CD1-CD1 3.79Å; I327-F341 HydrophobicContact CD1-CE1 4.33Å; I327-L344 HydrophobicContact CD1-CD2 3.63Å; I327-L344 HydrophobicContact CD1-CG 4.28Å; I327-L344 HydrophobicContact CG1-CD2 4.16Å; I327-L344 HydrophobicContact CG1-CG 4.43Å; I327-A345 HydrophobicContact CG2-CB 3.81Å; I327-I348 HydrophobicContact CG1-CD1 4.24Å
328	L	89.4	Confident	82.9	Confident	52 Å²	52	63 Å²	63	27%	0.272	32%	0.317	S	S	.	.	H	α-helix	trans	-65	-35.1	176.3	-69.4	178.1	0	0	0	111.8	L324 E325 L331 K332 W370	L324-L328 HydrophobicContact CD1-CD1 3.97Å; L324-L328 HydrophobicContact CD1-CG 4.01Å; L324-L328 HydrophobicContact CG-CD1 3.86Å; L324-L328 HydrophobicContact CG-CG 4.29Å; L324-L328 WeakPolarHBondContact O-CB 3.47Å; L324-L328 VanDerWaalsContact O-CG 3.25Å; L324-L328 WeakPolarHBondContact O-CG 2.98Å; L324-L328 PolarHBondContact O-N 2.86Å; E325-L328 PolarHBondContact O-N 3.34Å; L328-L331 PolarHBondContact O-N 2.98Å; L328-K332 PolarHBondContact O-N 3.47Å; L328-W370 HydrophobicContact CD2-CH2 3.99Å; L328-W370 HydrophobicContact CD2-CZ2 3.28Å
329	D	86.2	Confident	82.6	Confident	89 Å²	89	58 Å²	58	48%	0.476	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-43.5	175.6	-161.2	47.9	0	0	0	112	E325 L326 I327 L331 K332	E325-D329 WeakPolarHBondContact O-CB 3.49Å; E325-D329 PolarHBondContact O-N 3.07Å; L326-D329 PolarHBondContact O-N 2.94Å; I327-D329 VanDerWaalsContact C-N 3.29Å; I327-D329 PolarHBondContact O-N 2.96Å; D329-L331 VanDerWaalsContact C-N 3.34Å; D329-L331 PolarHBondContact O-N 3.43Å; D329-K332 WeakPolarHBondContact O-CB 3.43Å; D329-K332 PolarHBondContact O-N 3Å; D329-K332 WeakPolarHBondContact OD1-CE 3.45Å; D329-K332 IonicContact OD1-NZ 3.84Å; D329-K332 PolarHBondContact OD1-NZ 3.18Å
330	I	84.6	Confident	82.2	Confident	11 Å²	11	62.9 Å²	62.9	6%	0.056	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-43.9	175.6	-65.7	162.1	0	0	0	111	Q304 L326 I327 K332 S333 N336 F341	Q304-I330 HydrophobicContact CB-CD1 3.57Å; Q304-I330 HydrophobicContact CG-CD1 4.3Å; Q304-I330 VanDerWaalsContact OE1-CD1 3.24Å; L326-I330 HydrophobicContact CD1-CD1 4.24Å; L326-I330 HydrophobicContact CG-CD1 4.05Å; L326-I330 WeakPolarHBondContact O-CD1 3.45Å; L326-I330 VanDerWaalsContact O-CG1 3.27Å; L326-I330 WeakPolarHBondContact O-CG1 3.43Å; L326-I330 PolarHBondContact O-N 2.9Å; L326-I330 VanDerWaalsContact O-N 3.09Å; I327-I330 HydrophobicContact CD1-CD1 4.48Å; I327-I330 PolarHBondContact O-N 3.25Å; I330-K332 PolarHBondContact O-N 2.62Å; I330-S333 PolarHBondContact O-N 3.49Å; I330-S333 VanDerWaalsContact O-N 3.15Å; I330-S333 PolarHBondContact O-OG 2.98Å; I330-N336 HydrophobicContact CG2-CB 3.87Å; I330-F341 HydrophobicContact CD1-CE1 4.28Å; I330-F341 HydrophobicContact CG2-CD1 4.21Å; I330-F341 HydrophobicContact CG2-CE1 4.12Å; I330-F341 HydrophobicContact CG2-CZ 4.49Å
331	L	85.5	Confident	82.2	Confident	15 Å²	15	62.1 Å²	62.1	8%	0.079	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.1	-179.6	-71.9	170	0	0	0	114.2	I327 L328 D329 S333 F341 L342 A345 W370	I327-L331 HydrophobicContact CG2-CD1 3.72Å; I327-L331 HydrophobicContact CG2-CG 4.41Å; I327-L331 WeakPolarHBondContact O-CB 3.3Å; I327-L331 VanDerWaalsContact O-CG 3.28Å; I327-L331 WeakPolarHBondContact O-CG 3.49Å; I327-L331 PolarHBondContact O-N 3.41Å; L328-L331 PolarHBondContact O-N 2.98Å; D329-L331 VanDerWaalsContact C-N 3.34Å; D329-L331 PolarHBondContact O-N 3.43Å; L331-S333 PolarHBondContact O-N 2.86Å; L331-F341 HydrophobicContact CD2-CB 3.8Å; L331-F341 HydrophobicContact CG-CB 4.32Å; L331-L342 HydrophobicContact CD1-CD2 4.29Å; L331-L342 HydrophobicContact CD2-CD2 3.74Å; L331-L342 HydrophobicContact CD2-CG 4.31Å; L331-A345 HydrophobicContact CD1-CB 4.22Å; L331-W370 HydrophobicContact CD1-CE3 4.18Å; L331-W370 HydrophobicContact CD1-CH2 3.87Å; L331-W370 HydrophobicContact CD1-CZ3 3.62Å
332	K	82.5	Confident	82.2	Confident	157 Å²	157	60.5 Å²	60.5	68%	0.683	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.3	169.4	-68	172	-170.7	161.3	0	112.2	L328 D329 I330	L328-K332 PolarHBondContact O-N 3.47Å; D329-K332 WeakPolarHBondContact O-CB 3.43Å; D329-K332 PolarHBondContact O-N 3Å; D329-K332 WeakPolarHBondContact OD1-CE 3.45Å; D329-K332 IonicContact OD1-NZ 3.84Å; D329-K332 PolarHBondContact OD1-NZ 3.18Å; I330-K332 PolarHBondContact O-N 2.62Å
333	S	76.5	Confident	82	Confident	47 Å²	47	56.6 Å²	56.6	33%	0.329	29%	0.288	S	S	.	.	S	Bend	trans	-83.5	121.2	174.8	61.6	0	0	0	0	110.2	I330 L331 D335 N336	I330-S333 PolarHBondContact O-N 3.49Å; I330-S333 VanDerWaalsContact O-N 3.15Å; I330-S333 PolarHBondContact O-OG 2.98Å; L331-S333 PolarHBondContact O-N 2.86Å; S333-D335 PolarHBondContact O-N 3.22Å; S333-N336 PolarHBondContact O-N 3.22Å; S333-N336 VanDerWaalsContact O-N 3.09Å; S333-N336 PolarHBondContact OG-ND2 3.22Å
334	Q	63.4	Low	81.9	Confident	169 Å²	169	57 Å²	57	79%	0.79	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-60.6	-27.2	-179.1	-75.2	-172.8	-15.5	0	0	112.8	N336 E337	Q334-N336 PolarHBondContact O-N 3.11Å; Q334-E337 PolarHBondContact O-N 2.96Å
335	D	67.7	Low	81.9	Confident	155 Å²	155	56.2 Å²	56.2	83%	0.829	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-64.9	-18.6	177.8	-65.7	-27.8	0	0	0	113.3	S333	S333-D335 PolarHBondContact O-N 3.22Å
336	N	66.5	Low	81.8	Confident	36 Å²	36	49.4 Å²	49.4	19%	0.193	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-106.2	16.1	-176.1	-71.8	-41.4	0	0	0	114.1	I330 S333 Q334 V338	I330-N336 HydrophobicContact CG2-CB 3.87Å; S333-N336 PolarHBondContact O-N 3.22Å; S333-N336 VanDerWaalsContact O-N 3.09Å; S333-N336 PolarHBondContact OG-ND2 3.22Å; Q334-N336 PolarHBondContact O-N 3.11Å; N336-V338 PolarHBondContact O-N 3.43Å
337	E	74.1	Confident	81.7	Confident	73 Å²	73	50.6 Å²	50.6	34%	0.341	26%	0.258	S	S	.	.			trans	-72.9	51.6	172.7	-64	-161.8	168.3	0	0	112.7	Q334 K373	Q334-E337 PolarHBondContact O-N 2.96Å; E337-K373 IonicContact OE1-NZ 3.07Å; E337-K373 PolarHBondContact OE1-NZ 3.27Å; E337-K373 WeakPolarHBondContact OE2-CE 3.42Å; E337-K373 IonicContact OE2-NZ 2.78Å; E337-K373 PolarHBondContact OE2-NZ 3.24Å
338	V	80	Confident	81.7	Confident	64 Å²	64	50.6 Å²	50.6	39%	0.388	26%	0.258	S	S	.	.			trans	-86	140.8	177	-171.5	0	0	0	0	109	N336 D340 F341 L342	N336-V338 PolarHBondContact O-N 3.43Å; V338-D340 PolarHBondContact O-N 3.47Å; V338-F341 HydrophobicContact CB-CD2 4.12Å; V338-F341 PolarHBondContact O-N 3.4Å; V338-F341 VanDerWaalsContact O-N 3.14Å; V338-L342 PolarHBondContact O-N 3.04Å
339	P	77	Confident	81.8	Confident	12 Å²	12	49.4 Å²	49.4	8%	0.078	25%	0.25	C	C	.	.	H	α-helix	trans	-50.2	-34.2	-178.5	-30.4	35	0	0	0	114.9	L342 C343 T377 Q378	P339-L342 PolarHBondContact O-N 2.9Å; P339-C343 VanDerWaalsContact O-CB 3.25Å; P339-C343 WeakPolarHBondContact O-CB 3.38Å; P339-C343 PolarHBondContact O-N 2.83Å; P339-C343 PolarHBondContact O-SG 2.93Å; P339-T377 HydrophobicContact CG-CG2 3.87Å; P339-Q378 HydrophobicContact CB-CB 4.26Å; P339-Q378 HydrophobicContact CG-CB 3.49Å; P339-Q378 VanDerWaalsContact CG-CB 3.49Å
340	D	78.9	Confident	81.7	Confident	101 Å²	101	45.7 Å²	45.7	54%	0.54	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-48.2	-179.6	-71.1	-10	0	0	0	112.4	F305 V338 C343 L344	F305-D340 HydrophobicContact CD2-CB 4.47Å; F305-D340 HydrophobicContact CE2-CB 3.83Å; F305-D340 HydrophobicContact CZ-CB 4.26Å; V338-D340 PolarHBondContact O-N 3.47Å; D340-C343 PolarHBondContact O-N 3.32Å; D340-L344 VanDerWaalsContact O-CB 3.29Å; D340-L344 WeakPolarHBondContact O-CB 3.33Å; D340-L344 PolarHBondContact O-N 3.41Å
341	F	86.6	Confident	81.7	Confident	16 Å²	16	46 Å²	46	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-41.6	177.9	-70.7	-77.9	0	0	0	111.6	P301 F305 I327 I330 L331 V338 L344 A345	P301-F341 HydrophobicContact CB-CE2 4.28Å; P301-F341 HydrophobicContact CB-CZ 3.8Å; P301-F341 WeakPolarHBondContact O-CZ 3.28Å; F305-F341 HydrophobicContact CB-CD1 4.47Å; F305-F341 HydrophobicContact CB-CE1 3.65Å; F305-F341 HydrophobicContact CB-CZ 3.92Å; F305-F341 AromaticContact CD2-CD1 3.94Å; F305-F341 HydrophobicContact CD2-CD1 3.94Å; F305-F341 AromaticContact CD2-CE1 3.93Å; F305-F341 HydrophobicContact CD2-CE1 3.93Å; F305-F341 HydrophobicContact CD2-CG 4.42Å; F305-F341 HydrophobicContact CD2-CZ 4.4Å; F305-F341 HydrophobicContact CG-CE1 4.3Å; I327-F341 HydrophobicContact CD1-CD1 3.79Å; I327-F341 HydrophobicContact CD1-CE1 4.33Å; I330-F341 HydrophobicContact CD1-CE1 4.28Å; I330-F341 HydrophobicContact CG2-CD1 4.21Å; I330-F341 HydrophobicContact CG2-CE1 4.12Å; I330-F341 HydrophobicContact CG2-CZ 4.49Å; L331-F341 HydrophobicContact CD2-CB 3.8Å; L331-F341 HydrophobicContact CG-CB 4.32Å; V338-F341 HydrophobicContact CB-CD2 4.12Å; V338-F341 PolarHBondContact O-N 3.4Å; V338-F341 VanDerWaalsContact O-N 3.14Å; F341-L344 PolarHBondContact O-N 3.35Å; F341-A345 PolarHBondContact O-N 3.03Å
342	L	88	Confident	81.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-47	177.1	-62.3	172.6	0	0	0	111.3	L331 V338 P339 L344 A345 G346 W370 K373	L331-L342 HydrophobicContact CD1-CD2 4.29Å; L331-L342 HydrophobicContact CD2-CD2 3.74Å; L331-L342 HydrophobicContact CD2-CG 4.31Å; V338-L342 PolarHBondContact O-N 3.04Å; P339-L342 PolarHBondContact O-N 2.9Å; L342-L344 VanDerWaalsContact C-N 3.34Å; L342-L344 PolarHBondContact O-N 3.45Å; L342-A345 PolarHBondContact O-N 3.09Å; L342-G346 PolarHBondContact O-N 3.37Å; L342-W370 HydrophobicContact CD2-CE3 3.73Å; L342-W370 HydrophobicContact CD2-CZ3 3.6Å; L342-K373 HydrophobicContact CD1-CG 4.1Å; L342-K373 HydrophobicContact CD2-CD 3.86Å; L342-K373 HydrophobicContact CD2-CG 4.16Å
343	C	86.6	Confident	81.8	Confident	10 Å²	10	43.5 Å²	43.5	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-68.9	-32.1	178.1	-68.3	0	0	0	0	112.3	P339 D340 G346 R347 Y371 Y382	P339-C343 VanDerWaalsContact O-CB 3.25Å; P339-C343 WeakPolarHBondContact O-CB 3.38Å; P339-C343 PolarHBondContact O-N 2.83Å; P339-C343 PolarHBondContact O-SG 2.93Å; D340-C343 PolarHBondContact O-N 3.32Å; C343-G346 PolarHBondContact O-N 2.81Å; C343-R347 WeakPolarHBondContact O-CB 3.43Å; C343-R347 PolarHBondContact O-N 3.15Å; C343-Y371 HydrophobicContact CB-CE1 4.29Å; C343-Y382 HydrophobicContact CB-CE1 4.35Å
344	L	87.8	Confident	81.9	Confident	8 Å²	8	43 Å²	43	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-42	174.3	-178.9	56.5	0	0	0	111.4	F305 A308 F309 I327 D340 F341 L342 G346 R347 I348	F305-L344 HydrophobicContact CD2-CD2 3.64Å; F305-L344 HydrophobicContact CE2-CB 3.91Å; F305-L344 HydrophobicContact CE2-CD2 3.56Å; F305-L344 HydrophobicContact CE2-CG 4.33Å; F305-L344 HydrophobicContact CG-CD2 4.32Å; F305-L344 HydrophobicContact CZ-CD2 4.18Å; A308-L344 HydrophobicContact CB-CD2 4.1Å; F309-L344 HydrophobicContact CB-CD1 4.37Å; F309-L344 HydrophobicContact CB-CD2 4.35Å; F309-L344 HydrophobicContact CD2-CD1 4Å; I327-L344 HydrophobicContact CD1-CD2 3.63Å; I327-L344 HydrophobicContact CD1-CG 4.28Å; I327-L344 HydrophobicContact CG1-CD2 4.16Å; I327-L344 HydrophobicContact CG1-CG 4.43Å; D340-L344 VanDerWaalsContact O-CB 3.29Å; D340-L344 WeakPolarHBondContact O-CB 3.33Å; D340-L344 PolarHBondContact O-N 3.41Å; F341-L344 PolarHBondContact O-N 3.35Å; L342-L344 VanDerWaalsContact C-N 3.34Å; L342-L344 PolarHBondContact O-N 3.45Å; L344-G346 VanDerWaalsContact C-N 3.35Å; L344-G346 PolarHBondContact O-N 2.88Å; L344-R347 WeakPolarHBondContact O-CB 3.34Å; L344-R347 PolarHBondContact O-N 3.46Å; L344-I348 HydrophobicContact CD1-CD1 4.34Å; L344-I348 HydrophobicContact CD1-CG1 4.35Å; L344-I348 HydrophobicContact CG-CD1 4.16Å; L344-I348 VanDerWaalsContact O-CG1 3.3Å; L344-I348 WeakPolarHBondContact O-CG1 3.3Å; L344-I348 PolarHBondContact O-N 3.23Å
345	A	89.5	Confident	82.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-49.4	171.3	0	0	0	0	0	110.9	I327 L331 F341 L342 R347 I348 Y349 W370	I327-A345 HydrophobicContact CG2-CB 3.81Å; L331-A345 HydrophobicContact CD1-CB 4.22Å; F341-A345 PolarHBondContact O-N 3.03Å; L342-A345 PolarHBondContact O-N 3.09Å; A345-R347 VanDerWaalsContact C-N 3.27Å; A345-R347 PolarHBondContact O-N 2.83Å; A345-I348 PolarHBondContact O-N 3.46Å; A345-Y349 VanDerWaalsContact O-CD2 3.27Å; A345-Y349 WeakPolarHBondContact O-CD2 3.49Å; A345-Y349 PolarHBondContact O-N 3.25Å; A345-Y349 VanDerWaalsContact O-N 3.09Å; A345-W370 HydrophobicContact CB-CB 4.2Å; A345-W370 HydrophobicContact CB-CD2 3.76Å; A345-W370 HydrophobicContact CB-CE3 4.17Å; A345-W370 HydrophobicContact CB-CG 3.75Å
346	G	89.1	Confident	83.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.8	-39	175.5	0	0	0	0	0	112.9	L342 C343 L344 K350 Y371	L342-G346 PolarHBondContact O-N 3.37Å; C343-G346 PolarHBondContact O-N 2.81Å; L344-G346 VanDerWaalsContact C-N 3.35Å; L344-G346 PolarHBondContact O-N 2.88Å; G346-K350 WeakPolarHBondContact O-CB 3.43Å; G346-K350 PolarHBondContact O-N 3.1Å; G346-Y371 WeakPolarHBondContact O-CE2 3.32Å
347	R	87.1	Confident	84	Confident	47 Å²	47	41.8 Å²	41.8	18%	0.177	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-44.5	177.1	-179.3	64.8	-164.9	-164.6	10.1	112.3	C343 L344 A345 Y349 K350 D351 Y371	C343-R347 WeakPolarHBondContact O-CB 3.43Å; C343-R347 PolarHBondContact O-N 3.15Å; L344-R347 WeakPolarHBondContact O-CB 3.34Å; L344-R347 PolarHBondContact O-N 3.46Å; A345-R347 VanDerWaalsContact C-N 3.27Å; A345-R347 PolarHBondContact O-N 2.83Å; R347-Y349 VanDerWaalsContact C-N 3.34Å; R347-K350 PolarHBondContact O-N 3.28Å; R347-D351 IonicContact CZ-OD1 2.72Å; R347-D351 IonicContact CZ-OD2 2.91Å; R347-D351 IonicContact NE-OD1 3.01Å; R347-D351 PolarHBondContact NE-OD1 3.01Å; R347-D351 IonicContact NE-OD2 2.64Å; R347-D351 PolarHBondContact NE-OD2 2.64Å; R347-D351 IonicContact NH2-OD1 3.54Å; R347-D351 PolarHBondContact NH2-OD1 2.74Å; R347-D351 IonicContact NH2-OD2 3.47Å; R347-D351 WeakPolarHBondContact O-CB 3.48Å; R347-D351 PolarHBondContact O-N 2.86Å; R347-Y371 WeakPolarHBondContact CA-OH 3.44Å; R347-Y371 PolarHBondContact N-OH 3Å
348	I	88.6	Confident	84.2	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-45.9	178.4	-68.9	165.3	0	0	0	110.3	N312 R320 A323 L324 I327 L344 A345 D351 R352	N312-I348 HydrophobicContact CB-CG1 3.93Å; R320-I348 HydrophobicContact CG-CG2 3.59Å; A323-I348 HydrophobicContact CB-CD1 3.99Å; L324-I348 HydrophobicContact CB-CG2 3.98Å; L324-I348 HydrophobicContact CD1-CG2 4.18Å; I327-I348 HydrophobicContact CG1-CD1 4.24Å; L344-I348 HydrophobicContact CD1-CD1 4.34Å; L344-I348 HydrophobicContact CD1-CG1 4.35Å; L344-I348 HydrophobicContact CG-CD1 4.16Å; L344-I348 VanDerWaalsContact O-CG1 3.3Å; L344-I348 WeakPolarHBondContact O-CG1 3.3Å; L344-I348 PolarHBondContact O-N 3.23Å; A345-I348 PolarHBondContact O-N 3.46Å; I348-D351 PolarHBondContact O-N 2.68Å; I348-R352 WeakPolarHBondContact O-CB 3.38Å; I348-R352 PolarHBondContact O-N 3.48Å
349	Y	91.9	Very high	84.4	Confident	27 Å²	27	45 Å²	45	11%	0.106	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-39.8	175.2	-79.8	-67	0	0	0	112.9	L324 A345 R347 R352 F353 A363 Q366 W370	L324-Y349 HydrophobicContact CD1-CD2 3.98Å; L324-Y349 HydrophobicContact CD1-CE1 4.37Å; L324-Y349 HydrophobicContact CD1-CE2 3.41Å; L324-Y349 VanDerWaalsContact CD1-CE2 3.41Å; L324-Y349 HydrophobicContact CD2-CD1 4.42Å; L324-Y349 HydrophobicContact CD2-CE1 3.69Å; L324-Y349 HydrophobicContact CD2-CE2 4.24Å; L324-Y349 HydrophobicContact CG-CE2 4.41Å; A345-Y349 VanDerWaalsContact O-CD2 3.27Å; A345-Y349 WeakPolarHBondContact O-CD2 3.49Å; A345-Y349 PolarHBondContact O-N 3.25Å; A345-Y349 VanDerWaalsContact O-N 3.09Å; R347-Y349 VanDerWaalsContact C-N 3.34Å; Y349-R352 WeakPolarHBondContact O-CB 3.28Å; Y349-R352 PolarHBondContact O-N 3.13Å; Y349-F353 PolarHBondContact O-N 2.93Å; Y349-A363 WeakPolarHBondContact CB-O 3.28Å; Y349-A363 HydrophobicContact CD1-CB 4.29Å; Y349-Q366 HydrophobicContact CD1-CB 3.57Å; Y349-Q366 HydrophobicContact CD1-CG 4.29Å; Y349-Q366 HydrophobicContact CD2-CB 3.82Å; Y349-Q366 HydrophobicContact CE1-CB 3.63Å; Y349-Q366 HydrophobicContact CE1-CG 3.89Å; Y349-Q366 HydrophobicContact CE2-CB 3.87Å; Y349-Q366 HydrophobicContact CG-CB 3.67Å; Y349-W370 AromaticContact CD2-CD1 3.46Å; Y349-W370 VanDerWaalsContact CD2-CD1 3.46Å; Y349-W370 AromaticContact CD2-NE1 3.87Å; Y349-W370 AromaticContact CE2-CD1 3.46Å; Y349-W370 VanDerWaalsContact CE2-CD1 3.46Å; Y349-W370 AromaticContact CE2-NE1 3.33Å; Y349-W370 VanDerWaalsContact CE2-NE1 3.33Å
350	K	84.8	Confident	84.9	Confident	11 Å²	11	46.2 Å²	46.2	5%	0.048	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-44.5	174.6	-178.9	-174	179	-174.9	0	111.8	G346 R347 F353 S354 A367 Y371 N386 L390 N500	G346-K350 WeakPolarHBondContact O-CB 3.43Å; G346-K350 PolarHBondContact O-N 3.1Å; R347-K350 PolarHBondContact O-N 3.28Å; K350-F353 PolarHBondContact O-N 2.98Å; K350-S354 WeakPolarHBondContact O-CB 3.31Å; K350-S354 PolarHBondContact O-N 2.96Å; K350-S354 PolarHBondContact O-OG 2.72Å; K350-A367 HydrophobicContact CB-CB 4.27Å; K350-Y371 HydrophobicContact CB-CE2 4.31Å; K350-Y371 HydrophobicContact CD-CE2 4.44Å; K350-N386 PolarHBondContact NZ-OD1 3.11Å; K350-L390 HydrophobicContact CG-CD2 4.42Å; K350-N500 PolarHBondContact NZ-OD1 2.78Å
351	D	84.2	Confident	85.3	Confident	17 Å²	17	46 Å²	46	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-39.4	178.5	-71	-25.2	0	0	0	110.3	N312 R347 I348 S354 D355	N312-D351 PolarHBondContact ND2-OD2 2.89Å; R347-D351 IonicContact CZ-OD1 2.72Å; R347-D351 IonicContact CZ-OD2 2.91Å; R347-D351 IonicContact NE-OD1 3.01Å; R347-D351 PolarHBondContact NE-OD1 3.01Å; R347-D351 IonicContact NE-OD2 2.64Å; R347-D351 PolarHBondContact NE-OD2 2.64Å; R347-D351 IonicContact NH2-OD1 3.54Å; R347-D351 PolarHBondContact NH2-OD1 2.74Å; R347-D351 IonicContact NH2-OD2 3.47Å; R347-D351 WeakPolarHBondContact O-CB 3.48Å; R347-D351 PolarHBondContact O-N 2.86Å; I348-D351 PolarHBondContact O-N 2.68Å; D351-S354 PolarHBondContact O-N 3.39Å; D351-D355 PolarHBondContact O-N 3.07Å
352	R	85.8	Confident	85.5	Confident	112 Å²	112	52.7 Å²	52.7	42%	0.423	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-47.3	171.1	-179.8	177.8	175.3	150.7	5.3	112.6	I348 Y349 S354 D355 S356 D360 A363	I348-R352 WeakPolarHBondContact O-CB 3.38Å; I348-R352 PolarHBondContact O-N 3.48Å; Y349-R352 WeakPolarHBondContact O-CB 3.28Å; Y349-R352 PolarHBondContact O-N 3.13Å; R352-S354 VanDerWaalsContact C-N 3.32Å; R352-S354 PolarHBondContact O-N 3.09Å; R352-D355 PolarHBondContact O-N 3.16Å; R352-S356 PolarHBondContact O-N 2.65Å; R352-D360 IonicContact CZ-OD2 3.61Å; R352-D360 IonicContact NE-OD2 3.3Å; R352-D360 PolarHBondContact NE-OD2 3.2Å; R352-D360 IonicContact NH2-OD2 3.92Å; R352-A363 HydrophobicContact CB-CB 4.34Å; R352-A363 HydrophobicContact CG-CB 4.05Å
353	F	84.4	Confident	85.6	Confident	7 Å²	7	52.8 Å²	52.8	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-42.7	175.1	172	-117.6	0	0	0	111.9	Y349 K350 S356 F358 D360 A363 R364 I393	Y349-F353 PolarHBondContact O-N 2.93Å; K350-F353 PolarHBondContact O-N 2.98Å; F353-S356 PolarHBondContact O-N 3.26Å; F353-S356 PolarHBondContact O-OG 3.16Å; F353-F358 HydrophobicContact CD1-CD1 4.1Å; F353-F358 HydrophobicContact CE1-CB 4.23Å; F353-F358 AromaticContact CE1-CD1 3.65Å; F353-F358 HydrophobicContact CE1-CD1 3.65Å; F353-F358 HydrophobicContact CE1-CG 4.42Å; F353-F358 VanDerWaalsContact CE2-C 3.45Å; F353-F358 HydrophobicContact CE2-CB 3.85Å; F353-F358 WeakPolarHBondContact CE2-O 3.39Å; F353-F358 HydrophobicContact CZ-CB 3.61Å; F353-F358 AromaticContact CZ-CD1 3.95Å; F353-F358 HydrophobicContact CZ-CD1 3.95Å; F353-F358 HydrophobicContact CZ-CG 4.27Å; F353-F358 PolarHBondContact O-N 3.32Å; F353-F358 VanDerWaalsContact O-N 3.12Å; F353-D360 WeakPolarHBondContact CD2-O 3.17Å; F353-A363 HydrophobicContact CB-CB 4.2Å; F353-R364 HydrophobicContact CD1-CB 4.35Å; F353-R364 HydrophobicContact CD2-CB 3.86Å; F353-R364 HydrophobicContact CE1-CB 4.46Å; F353-R364 HydrophobicContact CE1-CG 4.38Å; F353-R364 HydrophobicContact CE2-CB 3.95Å; F353-R364 HydrophobicContact CE2-CG 4.49Å; F353-R364 HydrophobicContact CG-CB 4.04Å; F353-R364 HydrophobicContact CZ-CB 4.26Å; F353-R364 HydrophobicContact CZ-CG 4.32Å; F353-I393 HydrophobicContact CE1-CG2 3.95Å; F353-I393 HydrophobicContact CZ-CG2 3.88Å
354	S	78.8	Confident	85.8	Confident	37 Å²	37	54.4 Å²	54.4	26%	0.259	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-45.1	179.5	-56.1	0	0	0	0	112	K350 D351 R352 S356 R357	K350-S354 WeakPolarHBondContact O-CB 3.31Å; K350-S354 PolarHBondContact O-N 2.96Å; K350-S354 PolarHBondContact O-OG 2.72Å; D351-S354 PolarHBondContact O-N 3.39Å; R352-S354 VanDerWaalsContact C-N 3.32Å; R352-S354 PolarHBondContact O-N 3.09Å; S354-S356 VanDerWaalsContact C-N 3.28Å; S354-S356 PolarHBondContact O-N 2.87Å; S354-R357 PolarHBondContact O-N 3.28Å; S354-R357 VanDerWaalsContact O-N 3.1Å
355	D	77.7	Confident	86	Confident	95 Å²	95	57.5 Å²	57.5	51%	0.508	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-28.9	178.6	-75.3	0.2	0	0	0	112.7	N315 R320 D351 R352 R357	N315-D355 PolarHBondContact ND2-OD2 2.76Å; R320-D355 IonicContact CZ-OD2 2.81Å; R320-D355 IonicContact NH1-OD2 3.32Å; R320-D355 PolarHBondContact NH1-OD2 2.97Å; R320-D355 IonicContact NH2-OD2 3.14Å; R320-D355 PolarHBondContact NH2-OD2 3.16Å; D351-D355 PolarHBondContact O-N 3.07Å; R352-D355 PolarHBondContact O-N 3.16Å; D355-R357 PolarHBondContact O-N 2.72Å
356	S	84.2	Confident	86.2	Confident	32 Å²	32	61.2 Å²	61.2	22%	0.224	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	5.7	172.7	80.3	0	0	0	0	114.1	R352 F353 S354 F358 L359 D360	R352-S356 PolarHBondContact O-N 2.65Å; F353-S356 PolarHBondContact O-N 3.26Å; F353-S356 PolarHBondContact O-OG 3.16Å; S354-S356 VanDerWaalsContact C-N 3.28Å; S354-S356 PolarHBondContact O-N 2.87Å; S356-F358 PolarHBondContact O-N 3.27Å; S356-F358 PolarHBondContact OG-N 3.28Å; S356-L359 WeakPolarHBondContact O-CB 3.49Å; S356-L359 VanDerWaalsContact O-CG 3.32Å; S356-L359 WeakPolarHBondContact O-CG 3.39Å; S356-L359 PolarHBondContact O-N 3.4Å; S356-L359 PolarHBondContact OG-N 3.26Å; S356-L359 VanDerWaalsContact OG-N 3.14Å; S356-D360 WeakPolarHBondContact OG-CB 3.39Å; S356-D360 PolarHBondContact OG-N 3.11Å
357	R	78.8	Confident	86.3	Confident	208 Å²	208	61.2 Å²	61.2	79%	0.785	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	36.8	-168.8	-55	-176	-178.5	-164.7	0.5	112.5	S354 D355 L359	S354-R357 PolarHBondContact O-N 3.28Å; S354-R357 VanDerWaalsContact O-N 3.1Å; D355-R357 PolarHBondContact O-N 2.72Å; R357-L359 VanDerWaalsContact C-N 3.34Å
358	F	78.7	Confident	86.5	Confident	63 Å²	63	59.5 Å²	59.5	28%	0.276	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	25.8	178.2	-37.9	-67.2	0	0	0	114.8	F353 S356 L503	F353-F358 HydrophobicContact CD1-CD1 4.1Å; F353-F358 HydrophobicContact CE1-CB 4.23Å; F353-F358 AromaticContact CE1-CD1 3.65Å; F353-F358 HydrophobicContact CE1-CD1 3.65Å; F353-F358 HydrophobicContact CE1-CG 4.42Å; F353-F358 VanDerWaalsContact CE2-C 3.45Å; F353-F358 HydrophobicContact CE2-CB 3.85Å; F353-F358 WeakPolarHBondContact CE2-O 3.39Å; F353-F358 HydrophobicContact CZ-CB 3.61Å; F353-F358 AromaticContact CZ-CD1 3.95Å; F353-F358 HydrophobicContact CZ-CD1 3.95Å; F353-F358 HydrophobicContact CZ-CG 4.27Å; F353-F358 PolarHBondContact O-N 3.32Å; F353-F358 VanDerWaalsContact O-N 3.12Å; S356-F358 PolarHBondContact O-N 3.27Å; S356-F358 PolarHBondContact OG-N 3.28Å; F358-L503 HydrophobicContact CD1-CD2 3.82Å; F358-L503 HydrophobicContact CD2-CD2 4.32Å; F358-L503 HydrophobicContact CE1-CD1 4.03Å; F358-L503 HydrophobicContact CE1-CD2 3.44Å; F358-L503 VanDerWaalsContact CE1-CD2 3.44Å; F358-L503 HydrophobicContact CE1-CG 4.3Å; F358-L503 HydrophobicContact CE2-CD2 3.97Å; F358-L503 HydrophobicContact CG-CD2 4.25Å; F358-L503 HydrophobicContact CZ-CD2 3.53Å; F358-L503 HydrophobicContact CZ-CG 4.42Å
359	L	83.6	Confident	86.8	Confident	142 Å²	142	64.9 Å²	64.9	74%	0.743	30%	0.303	S	S	*	.			trans	-94.3	-27.1	178.7	-61.1	176.2	0	0	0	113.1	S356 R357 I361	S356-L359 WeakPolarHBondContact O-CB 3.49Å; S356-L359 VanDerWaalsContact O-CG 3.32Å; S356-L359 WeakPolarHBondContact O-CG 3.39Å; S356-L359 PolarHBondContact O-N 3.4Å; S356-L359 PolarHBondContact OG-N 3.26Å; S356-L359 VanDerWaalsContact OG-N 3.14Å; R357-L359 VanDerWaalsContact C-N 3.34Å; L359-I361 PolarHBondContact O-N 3.47Å
360	D	87.1	Confident	86.8	Confident	37 Å²	37	64.7 Å²	64.7	20%	0.198	30%	0.302	C	S	.	.			trans	-79.6	82.1	-177.8	-169.4	-15.8	0	0	0	111.5	R352 F353 S356 E362 A363 R364	R352-D360 IonicContact CZ-OD2 3.61Å; R352-D360 IonicContact NE-OD2 3.3Å; R352-D360 PolarHBondContact NE-OD2 3.2Å; R352-D360 IonicContact NH2-OD2 3.92Å; F353-D360 WeakPolarHBondContact CD2-O 3.17Å; S356-D360 WeakPolarHBondContact OG-CB 3.39Å; S356-D360 PolarHBondContact OG-N 3.11Å; D360-E362 VanDerWaalsContact C-N 3.27Å; D360-E362 PolarHBondContact O-N 3.24Å; D360-E362 PolarHBondContact OD1-N 2.98Å; D360-A363 HydrophobicContact CB-CB 3.98Å; D360-A363 PolarHBondContact O-N 3.34Å; D360-A363 WeakPolarHBondContact OD1-CB 3.43Å; D360-A363 PolarHBondContact OD1-N 3.04Å; D360-A363 WeakPolarHBondContact OD2-CB 3.48Å; D360-R364 PolarHBondContact O-N 3.18Å; D360-R364 VanDerWaalsContact O-N 3.15Å
361	I	88.2	Confident	87.2	Confident	96 Å²	96	64.2 Å²	64.2	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-36	-178.7	-56.2	178	0	0	0	111.2	L359 R364 D365	L359-I361 PolarHBondContact O-N 3.47Å; I361-R364 VanDerWaalsContact CG2-NH2 3.29Å; I361-R364 WeakPolarHBondContact O-CB 3.37Å; I361-R364 PolarHBondContact O-N 3.38Å; I361-D365 PolarHBondContact O-N 3.01Å
362	E	91	Very high	87.6	Confident	156 Å²	156	66.7 Å²	66.7	73%	0.729	31%	0.308	S	S	*	.	H	α-helix	trans	-64.3	-43.8	177.8	-67.2	-177.8	-179.7	0	0	111.2	D360 R364 D365 Q366	D360-E362 VanDerWaalsContact C-N 3.27Å; D360-E362 PolarHBondContact O-N 3.24Å; D360-E362 PolarHBondContact OD1-N 2.98Å; E362-R364 VanDerWaalsContact C-N 3.31Å; E362-R364 PolarHBondContact O-N 3.32Å; E362-D365 PolarHBondContact O-N 2.85Å; E362-Q366 WeakPolarHBondContact O-CB 3.39Å; E362-Q366 WeakPolarHBondContact O-CG 3.33Å; E362-Q366 PolarHBondContact O-N 3.38Å
363	A	89.2	Confident	87.8	Confident	2 Å²	2	63.3 Å²	63.3	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-37.5	174.4	0	0	0	0	0	112.3	Y349 R352 F353 D360 A367	Y349-A363 WeakPolarHBondContact CB-O 3.28Å; Y349-A363 HydrophobicContact CD1-CB 4.29Å; R352-A363 HydrophobicContact CB-CB 4.34Å; R352-A363 HydrophobicContact CG-CB 4.05Å; F353-A363 HydrophobicContact CB-CB 4.2Å; D360-A363 HydrophobicContact CB-CB 3.98Å; D360-A363 PolarHBondContact O-N 3.34Å; D360-A363 WeakPolarHBondContact OD1-CB 3.43Å; D360-A363 PolarHBondContact OD1-N 3.04Å; D360-A363 WeakPolarHBondContact OD2-CB 3.48Å; A363-A367 WeakPolarHBondContact O-CB 3.38Å; A363-A367 PolarHBondContact O-N 3.46Å
364	R	90.5	Very high	88	Confident	44 Å²	44	63 Å²	63	17%	0.166	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-48.4	172.9	-179.4	-157	67.8	-166.5	-0.8	111	F353 D360 I361 E362 A367 I368 L390	F353-R364 HydrophobicContact CD1-CB 4.35Å; F353-R364 HydrophobicContact CD2-CB 3.86Å; F353-R364 HydrophobicContact CE1-CB 4.46Å; F353-R364 HydrophobicContact CE1-CG 4.38Å; F353-R364 HydrophobicContact CE2-CB 3.95Å; F353-R364 HydrophobicContact CE2-CG 4.49Å; F353-R364 HydrophobicContact CG-CB 4.04Å; F353-R364 HydrophobicContact CZ-CB 4.26Å; F353-R364 HydrophobicContact CZ-CG 4.32Å; D360-R364 PolarHBondContact O-N 3.18Å; D360-R364 VanDerWaalsContact O-N 3.15Å; I361-R364 VanDerWaalsContact CG2-NH2 3.29Å; I361-R364 WeakPolarHBondContact O-CB 3.37Å; I361-R364 PolarHBondContact O-N 3.38Å; E362-R364 VanDerWaalsContact C-N 3.31Å; E362-R364 PolarHBondContact O-N 3.32Å; R364-A367 WeakPolarHBondContact O-CB 3.12Å; R364-A367 PolarHBondContact O-N 3.4Å; R364-I368 HydrophobicContact CG-CD1 4.18Å; R364-I368 WeakPolarHBondContact O-CG1 3.47Å; R364-I368 PolarHBondContact O-N 3.23Å; R364-L390 HydrophobicContact CG-CD2 4.36Å
365	D	92.4	Very high	88.5	Confident	73 Å²	73	62 Å²	62	39%	0.39	29%	0.286	S	S	.	.	H	α-helix	trans	-69.2	-36.1	-175.9	-67.8	-13	0	0	0	111.9	I361 E362 I368 Y369	I361-D365 PolarHBondContact O-N 3.01Å; E362-D365 PolarHBondContact O-N 2.85Å; D365-I368 PolarHBondContact O-N 3Å; D365-Y369 PolarHBondContact O-N 3.4Å
366	Q	93.5	Very high	89.1	Confident	79 Å²	79	64.2 Å²	64.2	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-42.6	169.5	-71.5	-62.1	-37.6	0	0	111.9	Y349 E362 I368 Y369 W370	Y349-Q366 HydrophobicContact CD1-CB 3.57Å; Y349-Q366 HydrophobicContact CD1-CG 4.29Å; Y349-Q366 HydrophobicContact CD2-CB 3.82Å; Y349-Q366 HydrophobicContact CE1-CB 3.63Å; Y349-Q366 HydrophobicContact CE1-CG 3.89Å; Y349-Q366 HydrophobicContact CE2-CB 3.87Å; Y349-Q366 HydrophobicContact CG-CB 3.67Å; E362-Q366 WeakPolarHBondContact O-CB 3.39Å; E362-Q366 WeakPolarHBondContact O-CG 3.33Å; E362-Q366 PolarHBondContact O-N 3.38Å; Q366-I368 VanDerWaalsContact C-N 3.32Å; Q366-I368 PolarHBondContact O-N 3.02Å; Q366-Y369 PolarHBondContact O-N 3.41Å; Q366-W370 PolarHBondContact O-N 3.29Å
367	A	91.6	Very high	89.2	Confident	0 Å²	0	66 Å²	66	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-44.2	175.3	0	0	0	0	0	111.5	K350 A363 R364 W370 Y371 L390	K350-A367 HydrophobicContact CB-CB 4.27Å; A363-A367 WeakPolarHBondContact O-CB 3.38Å; A363-A367 PolarHBondContact O-N 3.46Å; R364-A367 WeakPolarHBondContact O-CB 3.12Å; R364-A367 PolarHBondContact O-N 3.4Å; A367-W370 PolarHBondContact O-N 3.22Å; A367-Y371 WeakPolarHBondContact O-CB 3.47Å; A367-Y371 WeakPolarHBondContact O-CD2 3.28Å; A367-Y371 PolarHBondContact O-N 3.01Å; A367-L390 HydrophobicContact CB-CD1 3.72Å
368	I	92.2	Very high	89.5	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.051	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-47.6	175.6	-68.6	167.8	0	0	0	110.6	R364 D365 Q366 W370 Y371 R372 L387 L390 L391 A394	R364-I368 HydrophobicContact CG-CD1 4.18Å; R364-I368 WeakPolarHBondContact O-CG1 3.47Å; R364-I368 PolarHBondContact O-N 3.23Å; D365-I368 PolarHBondContact O-N 3Å; Q366-I368 VanDerWaalsContact C-N 3.32Å; Q366-I368 PolarHBondContact O-N 3.02Å; I368-W370 PolarHBondContact O-N 3.38Å; I368-Y371 PolarHBondContact O-N 3.45Å; I368-R372 WeakPolarHBondContact O-CB 3.45Å; I368-R372 PolarHBondContact O-N 2.9Å; I368-L387 HydrophobicContact CG2-CD1 4.02Å; I368-L390 HydrophobicContact CD1-CB 4.17Å; I368-L390 HydrophobicContact CG1-CB 3.53Å; I368-L390 HydrophobicContact CG1-CD1 4.4Å; I368-L391 HydrophobicContact CG2-CD2 3.97Å; I368-A394 HydrophobicContact CD1-CB 3.87Å
369	Y	93.8	Very high	89.8	Confident	114 Å²	114	61.5 Å²	61.5	45%	0.447	30%	0.297	S	S	.	.	H	α-helix	trans	-56.9	-49.6	178.9	172.2	-100.5	0	0	0	112.2	D365 Q366 R372 K373	D365-Y369 PolarHBondContact O-N 3.4Å; Q366-Y369 PolarHBondContact O-N 3.41Å; Y369-R372 PolarHBondContact O-N 2.9Å; Y369-K373 PolarHBondContact O-N 2.92Å
370	W	92.6	Very high	89.7	Confident	24 Å²	24	56.8 Å²	56.8	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-69.4	-40.9	-178	-73.5	112.8	0	0	0	113.2	L328 L331 L342 A345 Y349 Q366 A367 I368 R372 K373 G374	L328-W370 HydrophobicContact CD2-CH2 3.99Å; L328-W370 HydrophobicContact CD2-CZ2 3.28Å; L331-W370 HydrophobicContact CD1-CE3 4.18Å; L331-W370 HydrophobicContact CD1-CH2 3.87Å; L331-W370 HydrophobicContact CD1-CZ3 3.62Å; L342-W370 HydrophobicContact CD2-CE3 3.73Å; L342-W370 HydrophobicContact CD2-CZ3 3.6Å; A345-W370 HydrophobicContact CB-CB 4.2Å; A345-W370 HydrophobicContact CB-CD2 3.76Å; A345-W370 HydrophobicContact CB-CE3 4.17Å; A345-W370 HydrophobicContact CB-CG 3.75Å; Y349-W370 AromaticContact CD2-CD1 3.46Å; Y349-W370 VanDerWaalsContact CD2-CD1 3.46Å; Y349-W370 AromaticContact CD2-NE1 3.87Å; Y349-W370 AromaticContact CE2-CD1 3.46Å; Y349-W370 VanDerWaalsContact CE2-CD1 3.46Å; Y349-W370 AromaticContact CE2-NE1 3.33Å; Y349-W370 VanDerWaalsContact CE2-NE1 3.33Å; Q366-W370 PolarHBondContact O-N 3.29Å; A367-W370 PolarHBondContact O-N 3.22Å; I368-W370 PolarHBondContact O-N 3.38Å; W370-R372 VanDerWaalsContact C-N 3.34Å; W370-K373 HydrophobicContact CZ3-CD 4.35Å; W370-K373 PolarHBondContact O-N 3.02Å; W370-G374 PolarHBondContact O-N 2.98Å
371	Y	92.4	Very high	89.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-35.8	174.3	-82	-61.3	0	0	0	112.4	C343 G346 R347 K350 A367 I368 G374 F375 Y382 A383 N386 L390	C343-Y371 HydrophobicContact CB-CE1 4.29Å; G346-Y371 WeakPolarHBondContact O-CE2 3.32Å; R347-Y371 WeakPolarHBondContact CA-OH 3.44Å; R347-Y371 PolarHBondContact N-OH 3Å; K350-Y371 HydrophobicContact CB-CE2 4.31Å; K350-Y371 HydrophobicContact CD-CE2 4.44Å; A367-Y371 WeakPolarHBondContact O-CB 3.47Å; A367-Y371 WeakPolarHBondContact O-CD2 3.28Å; A367-Y371 PolarHBondContact O-N 3.01Å; I368-Y371 PolarHBondContact O-N 3.45Å; Y371-G374 PolarHBondContact O-N 3.15Å; Y371-F375 VanDerWaalsContact O-CB 3.3Å; Y371-F375 WeakPolarHBondContact O-CB 3.39Å; Y371-F375 PolarHBondContact O-N 3.25Å; Y371-Y382 AromaticContact CE1-CE1 4Å; Y371-Y382 HydrophobicContact CE1-CE1 4Å; Y371-A383 HydrophobicContact CD1-CB 4.42Å; Y371-N386 HydrophobicContact CD1-CB 4.08Å; Y371-N386 HydrophobicContact CD2-CB 4.19Å; Y371-N386 HydrophobicContact CE1-CB 3.78Å; Y371-N386 HydrophobicContact CE2-CB 3.88Å; Y371-N386 HydrophobicContact CG-CB 4.28Å; Y371-L390 HydrophobicContact CD2-CD1 3.6Å; Y371-L390 HydrophobicContact CE2-CD1 3.93Å
372	R	93.5	Very high	88.9	Confident	69 Å²	69	56.8 Å²	56.8	26%	0.26	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-51.8	173.6	-177.6	-178.3	-65.8	120.2	-3.4	110.9	I368 Y369 W370 G374 F375 E376 L387 E403	I368-R372 WeakPolarHBondContact O-CB 3.45Å; I368-R372 PolarHBondContact O-N 2.9Å; Y369-R372 PolarHBondContact O-N 2.9Å; W370-R372 VanDerWaalsContact C-N 3.34Å; R372-G374 VanDerWaalsContact C-N 3.3Å; R372-G374 PolarHBondContact O-N 2.91Å; R372-F375 PolarHBondContact O-N 2.97Å; R372-F375 VanDerWaalsContact O-N 3.13Å; R372-E376 HydrophobicContact CG-CG 4.43Å; R372-E376 WeakPolarHBondContact CG-OE1 3.47Å; R372-E376 WeakPolarHBondContact O-CG 3.38Å; R372-E376 PolarHBondContact O-N 3.22Å; R372-L387 HydrophobicContact CB-CD1 4.08Å; R372-L387 HydrophobicContact CB-CD2 4.26Å; R372-E403 IonicContact CZ-OE1 3.44Å; R372-E403 VanDerWaalsContact CZ-OE1 3.3Å; R372-E403 IonicContact CZ-OE2 2.9Å; R372-E403 IonicContact NE-OE1 3.61Å; R372-E403 PolarHBondContact NE-OE1 2.92Å; R372-E403 IonicContact NH2-OE1 2.72Å; R372-E403 PolarHBondContact NH2-OE1 3.05Å; R372-E403 IonicContact NH2-OE2 3.34Å; R372-E403 PolarHBondContact NH2-OE2 3.3Å; R372-E403 VanDerWaalsContact NH2-OE2 3.1Å
373	K	90.9	Very high	88.4	Confident	42 Å²	42	49.3 Å²	49.3	18%	0.183	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-42	177.5	-168.1	174.9	175.6	179.9	0	111.8	E337 L342 Y369 W370 T377	E337-K373 IonicContact OE1-NZ 3.07Å; E337-K373 PolarHBondContact OE1-NZ 3.27Å; E337-K373 WeakPolarHBondContact OE2-CE 3.42Å; E337-K373 IonicContact OE2-NZ 2.78Å; E337-K373 PolarHBondContact OE2-NZ 3.24Å; L342-K373 HydrophobicContact CD1-CG 4.1Å; L342-K373 HydrophobicContact CD2-CD 3.86Å; L342-K373 HydrophobicContact CD2-CG 4.16Å; Y369-K373 PolarHBondContact O-N 2.92Å; W370-K373 HydrophobicContact CZ3-CD 4.35Å; W370-K373 PolarHBondContact O-N 3.02Å; K373-T377 WeakPolarHBondContact O-CB 3.1Å; K373-T377 PolarHBondContact O-N 2.75Å; K373-T377 PolarHBondContact O-OG1 2.82Å
374	G	86.8	Confident	88.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-42.8	175.1	0	0	0	0	0	113.2	W370 Y371 R372 T377 Q378	W370-G374 PolarHBondContact O-N 2.98Å; Y371-G374 PolarHBondContact O-N 3.15Å; R372-G374 VanDerWaalsContact C-N 3.3Å; R372-G374 PolarHBondContact O-N 2.91Å; G374-T377 PolarHBondContact O-N 2.76Å; G374-Q378 PolarHBondContact O-N 2.87Å
375	F	89.8	Confident	87.9	Confident	15 Å²	15	47.5 Å²	47.5	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-71.5	-36.1	179.5	-171.2	-104.2	0	0	0	113.1	Y371 R372 T377 Q378 P379 A383 L387 I407 I410	Y371-F375 VanDerWaalsContact O-CB 3.3Å; Y371-F375 WeakPolarHBondContact O-CB 3.39Å; Y371-F375 PolarHBondContact O-N 3.25Å; R372-F375 PolarHBondContact O-N 2.97Å; R372-F375 VanDerWaalsContact O-N 3.13Å; F375-T377 VanDerWaalsContact C-N 3.35Å; F375-Q378 CarbonylContact O-C 3.56Å; F375-Q378 VanDerWaalsContact O-C 3.28Å; F375-P379 HydrophobicContact CD2-CB 4.38Å; F375-P379 HydrophobicContact CE2-CB 3.96Å; F375-P379 HydrophobicContact CZ-CB 4.1Å; F375-P379 WeakPolarHBondContact O-CA 3.35Å; F375-P379 WeakPolarHBondContact O-CD 3.48Å; F375-P379 WeakPolarHBondContact O-CG 3.28Å; F375-P379 VanDerWaalsContact O-N 3.15Å; F375-A383 HydrophobicContact CB-CB 4.29Å; F375-A383 HydrophobicContact CD2-CB 4.25Å; F375-L387 HydrophobicContact CB-CD2 4.2Å; F375-L387 HydrophobicContact CD1-CD2 4.41Å; F375-L387 HydrophobicContact CG-CD2 4.42Å; F375-I407 HydrophobicContact CE1-CG1 4.07Å; F375-I407 HydrophobicContact CZ-CG2 4.39Å; F375-I410 HydrophobicContact CE1-CD1 3.84Å; F375-I410 HydrophobicContact CE2-CG2 4.39Å; F375-I410 HydrophobicContact CZ-CB 4.05Å; F375-I410 HydrophobicContact CZ-CD1 4.04Å; F375-I410 HydrophobicContact CZ-CG2 3.69Å
376	E	89.7	Confident	87.4	Confident	142 Å²	142	44.2 Å²	44.2	66%	0.664	21%	0.207	S	C	*	.	H	α-helix	trans	-65.5	-38.2	172.8	-73.6	171.6	-178.6	0	0	111.8	R372	R372-E376 HydrophobicContact CG-CG 4.43Å; R372-E376 WeakPolarHBondContact CG-OE1 3.47Å; R372-E376 WeakPolarHBondContact O-CG 3.38Å; R372-E376 PolarHBondContact O-N 3.22Å
377	T	87.1	Confident	87.2	Confident	69 Å²	69	40.6 Å²	40.6	42%	0.423	19%	0.19	S	C	.	.	H	α-helix	trans	-68	-47.6	177.5	-54	0	0	0	0	111.3	P339 K373 G374 F375	P339-T377 HydrophobicContact CG-CG2 3.87Å; K373-T377 WeakPolarHBondContact O-CB 3.1Å; K373-T377 PolarHBondContact O-N 2.75Å; K373-T377 PolarHBondContact O-OG1 2.82Å; G374-T377 PolarHBondContact O-N 2.76Å; F375-T377 VanDerWaalsContact C-N 3.35Å
378	Q	84.2	Confident	86.9	Confident	114 Å²	114	40.8 Å²	40.8	53%	0.533	19%	0.192	S	C	.	.	S	Bend	trans	-149.3	111.6	173.1	-171.8	178.9	6.4	0	0	110.9	P339 G374 F375 N380	P339-Q378 HydrophobicContact CB-CB 4.26Å; P339-Q378 HydrophobicContact CG-CB 3.49Å; P339-Q378 VanDerWaalsContact CG-CB 3.49Å; G374-Q378 PolarHBondContact O-N 2.87Å; F375-Q378 CarbonylContact O-C 3.56Å; F375-Q378 VanDerWaalsContact O-C 3.28Å; Q378-N380 PolarHBondContact O-N 2.89Å; Q378-N380 PolarHBondContact O-ND2 3.41Å
379	P	85.1	Confident	86.5	Confident	64 Å²	64	40.4 Å²	40.4	42%	0.416	19%	0.189	S	C	.	.			trans	-63.5	113.5	176.4	-23.1	32.8	0	0	0	111.3	F375 I410	F375-P379 HydrophobicContact CD2-CB 4.38Å; F375-P379 HydrophobicContact CE2-CB 3.96Å; F375-P379 HydrophobicContact CZ-CB 4.1Å; F375-P379 WeakPolarHBondContact O-CA 3.35Å; F375-P379 WeakPolarHBondContact O-CD 3.48Å; F375-P379 WeakPolarHBondContact O-CG 3.28Å; F375-P379 VanDerWaalsContact O-N 3.15Å; P379-I410 HydrophobicContact CB-CG2 3.87Å
380	N	82.9	Confident	86.1	Confident	42 Å²	42	35 Å²	35	23%	0.225	17%	0.169	C	C	.	.			trans	-133.9	156	176.2	67.9	59.9	0	0	0	110.6	Q378 Y382 A383 G384	Q378-N380 PolarHBondContact O-N 2.89Å; Q378-N380 PolarHBondContact O-ND2 3.41Å; N380-Y382 VanDerWaalsContact C-N 3.32Å; N380-Y382 PolarHBondContact O-N 3.26Å; N380-Y382 PolarHBondContact OD1-N 3.33Å; N380-A383 WeakPolarHBondContact OD1-CB 3.31Å; N380-A383 PolarHBondContact OD1-N 3.09Å; N380-G384 PolarHBondContact O-N 2.81Å
381	E	79.8	Confident	85.8	Confident	40 Å²	40	34 Å²	34	19%	0.187	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-41	-174	-65.9	170	168.2	0	0	111.9	I385 L411 L414 K418 T432	E381-I385 WeakPolarHBondContact O-CB 3.4Å; E381-I385 VanDerWaalsContact O-CG1 3.28Å; E381-I385 WeakPolarHBondContact O-CG1 3.35Å; E381-I385 PolarHBondContact O-N 2.99Å; E381-L411 HydrophobicContact CB-CD2 4.5Å; E381-L414 HydrophobicContact CG-CB 4.19Å; E381-L414 HydrophobicContact CG-CD1 4.09Å; E381-K418 WeakPolarHBondContact OE1-CE 3.45Å; E381-K418 IonicContact OE1-NZ 3.52Å; E381-K418 PolarHBondContact OE1-NZ 2.96Å; E381-K418 IonicContact OE2-NZ 3.8Å; E381-K418 PolarHBondContact OE2-NZ 2.9Å; E381-T432 HydrophobicContact CB-CG2 4.07Å; E381-T432 HydrophobicContact CG-CG2 4.2Å
382	Y	78.2	Confident	85.3	Confident	93 Å²	93	34.6 Å²	34.6	37%	0.365	17%	0.168	S	C	.	.	H	α-helix	trans	-64	-49.9	-178.2	175.4	-97.2	0	0	0	113	C343 Y371 N380 N386	C343-Y382 HydrophobicContact CB-CE1 4.35Å; Y371-Y382 AromaticContact CE1-CE1 4Å; Y371-Y382 HydrophobicContact CE1-CE1 4Å; N380-Y382 VanDerWaalsContact C-N 3.32Å; N380-Y382 PolarHBondContact O-N 3.26Å; N380-Y382 PolarHBondContact OD1-N 3.33Å; Y382-N386 WeakPolarHBondContact CE2-ND2 3.24Å; Y382-N386 PolarHBondContact O-N 3.05Å; Y382-N386 PolarHBondContact O-ND2 3.03Å
383	A	81.1	Confident	84.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.4	-44.6	178.4	0	0	0	0	0	110.5	Y371 F375 N380 I385 N386 L387	Y371-A383 HydrophobicContact CD1-CB 4.42Å; F375-A383 HydrophobicContact CB-CB 4.29Å; F375-A383 HydrophobicContact CD2-CB 4.25Å; N380-A383 WeakPolarHBondContact OD1-CB 3.31Å; N380-A383 PolarHBondContact OD1-N 3.09Å; A383-I385 PolarHBondContact O-N 2.89Å; A383-N386 PolarHBondContact O-N 2.74Å; A383-L387 WeakPolarHBondContact O-CB 3.45Å; A383-L387 PolarHBondContact O-N 2.77Å
384	G	85.5	Confident	84.3	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-43.3	-179	0	0	0	0	0	113.1	N380 A388	N380-G384 PolarHBondContact O-N 2.81Å; G384-A388 VanDerWaalsContact O-CB 3.28Å; G384-A388 WeakPolarHBondContact O-CB 3.19Å; G384-A388 PolarHBondContact O-N 3.29Å
385	I	82.4	Confident	83.9	Confident	8 Å²	8	34 Å²	34	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-46.1	177.6	-72.8	173.2	0	0	0	111.5	E381 A383 L387 A388 T389 L411 T432 E435 I436	E381-I385 WeakPolarHBondContact O-CB 3.4Å; E381-I385 VanDerWaalsContact O-CG1 3.28Å; E381-I385 WeakPolarHBondContact O-CG1 3.35Å; E381-I385 PolarHBondContact O-N 2.99Å; A383-I385 PolarHBondContact O-N 2.89Å; I385-L387 VanDerWaalsContact C-N 3.35Å; I385-A388 PolarHBondContact O-N 3.1Å; I385-T389 WeakPolarHBondContact O-CB 3.27Å; I385-T389 PolarHBondContact O-N 3.23Å; I385-T389 PolarHBondContact O-OG1 2.96Å; I385-L411 HydrophobicContact CG1-CD1 4.07Å; I385-T432 HydrophobicContact CD1-CG2 3.55Å; I385-E435 HydrophobicContact CD1-CB 4.37Å; I385-E435 HydrophobicContact CG2-CB 4.48Å; I385-E435 WeakPolarHBondContact CG2-OE2 3.4Å; I385-I436 HydrophobicContact CD1-CD1 4.33Å; I385-I436 HydrophobicContact CD1-CG1 4.39Å; I385-I436 HydrophobicContact CG1-CD1 4.42Å; I385-I436 HydrophobicContact CG1-CG1 4.19Å
386	N	83.3	Confident	83.6	Confident	4 Å²	4	37 Å²	37	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-41.2	178.9	-76	-59.7	0	0	0	111.5	K350 Y371 Y382 A383 T389 L390	K350-N386 PolarHBondContact NZ-OD1 3.11Å; Y371-N386 HydrophobicContact CD1-CB 4.08Å; Y371-N386 HydrophobicContact CD2-CB 4.19Å; Y371-N386 HydrophobicContact CE1-CB 3.78Å; Y371-N386 HydrophobicContact CE2-CB 3.88Å; Y371-N386 HydrophobicContact CG-CB 4.28Å; Y382-N386 WeakPolarHBondContact CE2-ND2 3.24Å; Y382-N386 PolarHBondContact O-N 3.05Å; Y382-N386 PolarHBondContact O-ND2 3.03Å; A383-N386 PolarHBondContact O-N 2.74Å; N386-T389 PolarHBondContact O-N 2.99Å; N386-L390 VanDerWaalsContact O-CG 3.31Å; N386-L390 WeakPolarHBondContact O-CG 3.44Å; N386-L390 PolarHBondContact O-N 2.73Å
387	L	89.1	Confident	82.8	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-51.6	174.4	-178.9	57.9	0	0	0	111.3	I368 R372 F375 A383 I385 T389 L390 L391 I407	I368-L387 HydrophobicContact CG2-CD1 4.02Å; R372-L387 HydrophobicContact CB-CD1 4.08Å; R372-L387 HydrophobicContact CB-CD2 4.26Å; F375-L387 HydrophobicContact CB-CD2 4.2Å; F375-L387 HydrophobicContact CD1-CD2 4.41Å; F375-L387 HydrophobicContact CG-CD2 4.42Å; A383-L387 WeakPolarHBondContact O-CB 3.45Å; A383-L387 PolarHBondContact O-N 2.77Å; I385-L387 VanDerWaalsContact C-N 3.35Å; L387-T389 VanDerWaalsContact C-N 3.31Å; L387-T389 PolarHBondContact O-N 3.05Å; L387-L390 PolarHBondContact O-N 2.67Å; L387-L391 HydrophobicContact CD1-CD1 4.23Å; L387-L391 HydrophobicContact CD1-CG 4.27Å; L387-L391 HydrophobicContact CG-CD1 4.07Å; L387-L391 WeakPolarHBondContact O-CG 3.37Å; L387-L391 PolarHBondContact O-N 3.24Å; L387-I407 HydrophobicContact CD2-CD1 3.58Å; L387-I407 HydrophobicContact CD2-CG1 4.35Å; L387-I407 HydrophobicContact CG-CD1 3.8Å
388	A	85.4	Confident	82.2	Confident	5 Å²	5	31.1 Å²	31.1	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-59.4	-42.3	178.8	0	0	0	0	0	112	G384 I385 L391 V392 L404 I407 L439	G384-A388 VanDerWaalsContact O-CB 3.28Å; G384-A388 WeakPolarHBondContact O-CB 3.19Å; G384-A388 PolarHBondContact O-N 3.29Å; I385-A388 PolarHBondContact O-N 3.1Å; A388-L391 PolarHBondContact O-N 3.4Å; A388-V392 WeakPolarHBondContact O-CG2 3.44Å; A388-V392 PolarHBondContact O-N 3.21Å; A388-L404 HydrophobicContact CB-CD2 3.91Å; A388-I407 HydrophobicContact CB-CG2 4.14Å; A388-L439 HydrophobicContact CB-CD1 3.79Å; A388-L439 HydrophobicContact CB-CD2 4.22Å
389	T	82	Confident	81.6	Confident	1 Å²	1	32 Å²	32	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-46.9	176.5	-57.5	0	0	0	0	111.3	I385 N386 L387 V392 I393 N500 I504	I385-T389 WeakPolarHBondContact O-CB 3.27Å; I385-T389 PolarHBondContact O-N 3.23Å; I385-T389 PolarHBondContact O-OG1 2.96Å; N386-T389 PolarHBondContact O-N 2.99Å; L387-T389 VanDerWaalsContact C-N 3.31Å; L387-T389 PolarHBondContact O-N 3.05Å; T389-V392 PolarHBondContact O-N 3.28Å; T389-I393 HydrophobicContact CG2-CD1 4.06Å; T389-I393 VanDerWaalsContact O-CG1 3.32Å; T389-I393 WeakPolarHBondContact O-CG1 3.34Å; T389-I393 PolarHBondContact O-N 3.08Å; T389-N500 HydrophobicContact CG2-CB 3.93Å; T389-I504 HydrophobicContact CG2-CD1 4.34Å; T389-I504 HydrophobicContact CG2-CG1 4.28Å
390	L	86	Confident	81.3	Confident	2 Å²	2	34 Å²	34	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-35.8	-179.8	-70.2	164.7	0	0	0	112.6	K350 R364 A367 I368 Y371 N386 L387 I393 A394	K350-L390 HydrophobicContact CG-CD2 4.42Å; R364-L390 HydrophobicContact CG-CD2 4.36Å; A367-L390 HydrophobicContact CB-CD1 3.72Å; I368-L390 HydrophobicContact CD1-CB 4.17Å; I368-L390 HydrophobicContact CG1-CB 3.53Å; I368-L390 HydrophobicContact CG1-CD1 4.4Å; Y371-L390 HydrophobicContact CD2-CD1 3.6Å; Y371-L390 HydrophobicContact CE2-CD1 3.93Å; N386-L390 VanDerWaalsContact O-CG 3.31Å; N386-L390 WeakPolarHBondContact O-CG 3.44Å; N386-L390 PolarHBondContact O-N 2.73Å; L387-L390 PolarHBondContact O-N 2.67Å; L390-I393 PolarHBondContact O-N 2.65Å; L390-A394 WeakPolarHBondContact O-CB 3.37Å; L390-A394 PolarHBondContact O-N 2.9Å
391	L	87.2	Confident	81.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-41.7	173.5	-73.3	172.6	0	0	0	111.7	I368 L387 A388 A394 G395 H396 E403 L404 I407	I368-L391 HydrophobicContact CG2-CD2 3.97Å; L387-L391 HydrophobicContact CD1-CD1 4.23Å; L387-L391 HydrophobicContact CD1-CG 4.27Å; L387-L391 HydrophobicContact CG-CD1 4.07Å; L387-L391 WeakPolarHBondContact O-CG 3.37Å; L387-L391 PolarHBondContact O-N 3.24Å; A388-L391 PolarHBondContact O-N 3.4Å; L391-A394 WeakPolarHBondContact O-CB 3.24Å; L391-A394 PolarHBondContact O-N 3.08Å; L391-G395 PolarHBondContact O-N 2.71Å; L391-H396 HydrophobicContact CB-CB 4.34Å; L391-H396 VanDerWaalsContact O-CB 3.3Å; L391-H396 WeakPolarHBondContact O-CB 3.47Å; L391-H396 PolarHBondContact O-CD2 2.9Å; L391-H396 PolarHBondContact O-N 2.81Å; L391-E403 HydrophobicContact CD1-CG 4Å; L391-L404 HydrophobicContact CB-CD2 3.82Å; L391-L404 HydrophobicContact CB-CG 4.2Å; L391-L404 HydrophobicContact CD1-CD2 3.91Å; L391-L404 HydrophobicContact CD1-CG 4.26Å; L391-I407 HydrophobicContact CD1-CD1 3.72Å
392	V	81	Confident	81.7	Confident	13 Å²	13	35 Å²	35	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.2	173	0	0	0	0	111	A388 T389 A394 G395 H396 L404 L439 I504	A388-V392 WeakPolarHBondContact O-CG2 3.44Å; A388-V392 PolarHBondContact O-N 3.21Å; T389-V392 PolarHBondContact O-N 3.28Å; V392-A394 VanDerWaalsContact C-N 3.27Å; V392-A394 PolarHBondContact O-N 3.12Å; V392-G395 PolarHBondContact O-N 3.32Å; V392-H396 WeakPolarHBondContact CA-O 3.3Å; V392-L404 HydrophobicContact CG2-CD1 4.01Å; V392-L404 HydrophobicContact CG2-CD2 4.4Å; V392-L439 HydrophobicContact CG2-CD2 4.06Å; V392-I504 HydrophobicContact CG1-CG1 4.28Å; V392-I504 HydrophobicContact CG1-CG2 4.21Å
393	I	80.5	Confident	82.3	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-33.1	174.6	-66.1	164.9	0	0	0	111.7	F353 T389 L390 G395 L503 F507	F353-I393 HydrophobicContact CE1-CG2 3.95Å; F353-I393 HydrophobicContact CZ-CG2 3.88Å; T389-I393 HydrophobicContact CG2-CD1 4.06Å; T389-I393 VanDerWaalsContact O-CG1 3.32Å; T389-I393 WeakPolarHBondContact O-CG1 3.34Å; T389-I393 PolarHBondContact O-N 3.08Å; L390-I393 PolarHBondContact O-N 2.65Å; I393-G395 PolarHBondContact O-N 2.78Å; I393-L503 HydrophobicContact CD1-CB 3.87Å; I393-L503 HydrophobicContact CD1-CD1 3.93Å; I393-L503 HydrophobicContact CD1-CG 4.34Å; I393-L503 HydrophobicContact CG1-CB 4.26Å; I393-F507 HydrophobicContact CB-CD2 4.45Å; I393-F507 HydrophobicContact CG1-CD2 4.2Å; I393-F507 HydrophobicContact CG2-CD2 4.16Å; I393-F507 HydrophobicContact CG2-CE2 3.88Å; I393-F507 HydrophobicContact CG2-CZ 4.19Å
394	A	83.8	Confident	82.5	Confident	30 Å²	30	33 Å²	33	25%	0.248	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-2.3	173.7	0	0	0	0	0	113.7	I368 L390 L391 V392	I368-A394 HydrophobicContact CD1-CB 3.87Å; L390-A394 WeakPolarHBondContact O-CB 3.37Å; L390-A394 PolarHBondContact O-N 2.9Å; L391-A394 WeakPolarHBondContact O-CB 3.24Å; L391-A394 PolarHBondContact O-N 3.08Å; V392-A394 VanDerWaalsContact C-N 3.27Å; V392-A394 PolarHBondContact O-N 3.12Å
395	G	78.3	Confident	82.5	Confident	62 Å²	62	36.9 Å²	36.9	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	95	6	176.7	0	0	0	0	0	114.4	L391 V392 I393 S397	L391-G395 PolarHBondContact O-N 2.71Å; V392-G395 PolarHBondContact O-N 3.32Å; I393-G395 PolarHBondContact O-N 2.78Å; G395-S397 PolarHBondContact O-N 2.79Å
396	H	82.5	Confident	82.8	Confident	77 Å²	77	42.6 Å²	42.6	36%	0.356	24%	0.244	S	C	.	.			trans	-71.6	129	172.1	-66.6	-105.1	0	0	0	109.6	L391 V392 L404	L391-H396 HydrophobicContact CB-CB 4.34Å; L391-H396 VanDerWaalsContact O-CB 3.3Å; L391-H396 WeakPolarHBondContact O-CB 3.47Å; L391-H396 PolarHBondContact O-CD2 2.9Å; L391-H396 PolarHBondContact O-N 2.81Å; V392-H396 WeakPolarHBondContact CA-O 3.3Å; H396-L404 HydrophobicContact CB-CD1 3.74Å; H396-L404 HydrophobicContact CB-CG 4.48Å
397	S	74.2	Confident	82.9	Confident	26 Å²	26	42.7 Å²	42.7	18%	0.182	24%	0.244	C	C	.	.			trans	-97.7	150.7	171.1	81	0	0	0	0	110.6	G395 Q399 T400 S401	G395-S397 PolarHBondContact O-N 2.79Å; S397-Q399 PolarHBondContact O-N 3.26Å; S397-T400 PolarHBondContact N-OG1 3.47Å; S397-T400 PolarHBondContact O-N 2.85Å; S397-T400 VanDerWaalsContact O-N 3.11Å; S397-T400 PolarHBondContact O-OG1 3.43Å; S397-T400 WeakPolarHBondContact OG-CB 3.35Å; S397-T400 VanDerWaalsContact OG-CG2 3.28Å; S397-T400 WeakPolarHBondContact OG-CG2 3.47Å; S397-T400 PolarHBondContact OG-N 3.33Å; S397-T400 PolarHBondContact OG-OG1 2.96Å; S397-S401 WeakPolarHBondContact O-CB 3.33Å; S397-S401 PolarHBondContact O-N 2.94Å
398	F	73	Confident	82.6	Confident	62 Å²	62	43.3 Å²	43.3	27%	0.272	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-32.7	177.3	-171.9	-95.7	0	0	0	112.6	L404 Q405 A408 A440	F398-L404 HydrophobicContact CD2-CB 4.46Å; F398-Q405 HydrophobicContact CE1-CG 4.37Å; F398-Q405 HydrophobicContact CE2-CG 4.48Å; F398-Q405 HydrophobicContact CZ-CG 4.28Å; F398-Q405 WeakPolarHBondContact O-CG 3.36Å; F398-Q405 PolarHBondContact O-NE2 2.84Å; F398-A408 HydrophobicContact CE2-CB 3.56Å; F398-A408 HydrophobicContact CZ-CB 4.18Å; F398-A440 HydrophobicContact CE2-CB 4.42Å
399	Q	72.9	Confident	82.6	Confident	133 Å²	133	48.1 Å²	48.1	62%	0.621	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-31.7	-179.9	-63.1	168.7	13.1	0	0	112.5	S397	S397-Q399 PolarHBondContact O-N 3.26Å
400	T	77.2	Confident	82.8	Confident	107 Å²	107	50.5 Å²	50.5	66%	0.656	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-22.4	-172.9	59.5	0	0	0	0	113.8	S397	S397-T400 PolarHBondContact N-OG1 3.47Å; S397-T400 PolarHBondContact O-N 2.85Å; S397-T400 VanDerWaalsContact O-N 3.11Å; S397-T400 PolarHBondContact O-OG1 3.43Å; S397-T400 WeakPolarHBondContact OG-CB 3.35Å; S397-T400 VanDerWaalsContact OG-CG2 3.28Å; S397-T400 WeakPolarHBondContact OG-CG2 3.47Å; S397-T400 PolarHBondContact OG-N 3.33Å; S397-T400 PolarHBondContact OG-OG1 2.96Å
401	S	85.4	Confident	82.8	Confident	9 Å²	9	50.5 Å²	50.5	6%	0.063	29%	0.291	C	S	.	.			trans	-102.7	110.2	-174.1	-177.3	0	0	0	0	111.4	S397 E403 L404 Q405	S397-S401 WeakPolarHBondContact O-CB 3.33Å; S397-S401 PolarHBondContact O-N 2.94Å; S401-E403 PolarHBondContact O-N 2.89Å; S401-L404 PolarHBondContact O-N 3.49Å; S401-L404 PolarHBondContact OG-N 2.81Å; S401-Q405 WeakPolarHBondContact O-CG 3.43Å; S401-Q405 PolarHBondContact O-N 3.47Å
402	S	86.7	Confident	82.5	Confident	93 Å²	93	53.5 Å²	53.5	65%	0.65	31%	0.312	S	S	*	.	H	α-helix	trans	-60.2	-33.4	172.4	56.5	0	0	0	0	112	Q405 Q406	S402-Q405 PolarHBondContact O-N 3.16Å; S402-Q406 WeakPolarHBondContact O-CB 3.29Å; S402-Q406 PolarHBondContact O-N 3.04Å
403	E	90.4	Very high	82.6	Confident	44 Å²	44	54.7 Å²	54.7	21%	0.206	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-46.9	176.5	-174.3	179.9	-168.3	0	0	111.2	R372 L391 S401 Q405 Q406 I407	R372-E403 IonicContact CZ-OE1 3.44Å; R372-E403 VanDerWaalsContact CZ-OE1 3.3Å; R372-E403 IonicContact CZ-OE2 2.9Å; R372-E403 IonicContact NE-OE1 3.61Å; R372-E403 PolarHBondContact NE-OE1 2.92Å; R372-E403 IonicContact NH2-OE1 2.72Å; R372-E403 PolarHBondContact NH2-OE1 3.05Å; R372-E403 IonicContact NH2-OE2 3.34Å; R372-E403 PolarHBondContact NH2-OE2 3.3Å; R372-E403 VanDerWaalsContact NH2-OE2 3.1Å; L391-E403 HydrophobicContact CD1-CG 4Å; S401-E403 PolarHBondContact O-N 2.89Å; E403-Q405 VanDerWaalsContact C-N 3.32Å; E403-Q405 PolarHBondContact O-N 2.98Å; E403-Q406 PolarHBondContact O-N 3.34Å; E403-I407 HydrophobicContact CG-CD1 3.97Å; E403-I407 VanDerWaalsContact O-CG1 3.29Å; E403-I407 WeakPolarHBondContact O-CG1 3.1Å; E403-I407 PolarHBondContact O-N 3.22Å
404	L	85.7	Confident	82.8	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-38.7	177	-80.3	176.7	0	0	0	112.1	A388 L391 V392 H396 F398 S401 A408	A388-L404 HydrophobicContact CB-CD2 3.91Å; L391-L404 HydrophobicContact CB-CD2 3.82Å; L391-L404 HydrophobicContact CB-CG 4.2Å; L391-L404 HydrophobicContact CD1-CD2 3.91Å; L391-L404 HydrophobicContact CD1-CG 4.26Å; V392-L404 HydrophobicContact CG2-CD1 4.01Å; V392-L404 HydrophobicContact CG2-CD2 4.4Å; H396-L404 HydrophobicContact CB-CD1 3.74Å; H396-L404 HydrophobicContact CB-CG 4.48Å; F398-L404 HydrophobicContact CD2-CB 4.46Å; S401-L404 PolarHBondContact O-N 3.49Å; S401-L404 PolarHBondContact OG-N 2.81Å; L404-A408 WeakPolarHBondContact O-CB 3.36Å; L404-A408 PolarHBondContact O-N 3.47Å
405	Q	85.4	Confident	82.6	Confident	81 Å²	81	54.4 Å²	54.4	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-44.5	176.4	-67.5	172.7	1.5	0	0	111.2	F398 S401 S402 E403 A408 V409	F398-Q405 HydrophobicContact CE1-CG 4.37Å; F398-Q405 HydrophobicContact CE2-CG 4.48Å; F398-Q405 HydrophobicContact CZ-CG 4.28Å; F398-Q405 WeakPolarHBondContact O-CG 3.36Å; F398-Q405 PolarHBondContact O-NE2 2.84Å; S401-Q405 WeakPolarHBondContact O-CG 3.43Å; S401-Q405 PolarHBondContact O-N 3.47Å; S402-Q405 PolarHBondContact O-N 3.16Å; E403-Q405 VanDerWaalsContact C-N 3.32Å; E403-Q405 PolarHBondContact O-N 2.98Å; Q405-A408 PolarHBondContact O-N 3.34Å; Q405-V409 WeakPolarHBondContact O-CG2 3.49Å; Q405-V409 PolarHBondContact O-N 3.43Å
406	Q	87.9	Confident	82.5	Confident	128 Å²	128	53.9 Å²	53.9	60%	0.598	32%	0.316	S	S	*	.	H	α-helix	trans	-63.2	-45.9	177.5	-174.9	177.9	2.3	0	0	111.8	S402 E403 A408 V409 I410	S402-Q406 WeakPolarHBondContact O-CB 3.29Å; S402-Q406 PolarHBondContact O-N 3.04Å; E403-Q406 PolarHBondContact O-N 3.34Å; Q406-A408 VanDerWaalsContact C-N 3.32Å; Q406-A408 PolarHBondContact O-N 3.4Å; Q406-V409 PolarHBondContact O-N 2.81Å; Q406-I410 HydrophobicContact CG-CD1 4.06Å; Q406-I410 WeakPolarHBondContact O-CG1 3.42Å; Q406-I410 PolarHBondContact O-N 3.3Å
407	I	86.6	Confident	82.5	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-46.4	176.2	-66.9	163.2	0	0	0	110.1	F375 L387 A388 L391 E403 V409 I410 L411	F375-I407 HydrophobicContact CE1-CG1 4.07Å; F375-I407 HydrophobicContact CZ-CG2 4.39Å; L387-I407 HydrophobicContact CD2-CD1 3.58Å; L387-I407 HydrophobicContact CD2-CG1 4.35Å; L387-I407 HydrophobicContact CG-CD1 3.8Å; A388-I407 HydrophobicContact CB-CG2 4.14Å; L391-I407 HydrophobicContact CD1-CD1 3.72Å; E403-I407 HydrophobicContact CG-CD1 3.97Å; E403-I407 VanDerWaalsContact O-CG1 3.29Å; E403-I407 WeakPolarHBondContact O-CG1 3.1Å; E403-I407 PolarHBondContact O-N 3.22Å; I407-V409 PolarHBondContact O-N 3.42Å; I407-I410 PolarHBondContact O-N 2.8Å; I407-L411 HydrophobicContact CG2-CD1 3.68Å; I407-L411 HydrophobicContact CG2-CG 4.07Å; I407-L411 WeakPolarHBondContact O-CB 3.32Å; I407-L411 VanDerWaalsContact O-CG 3.28Å; I407-L411 WeakPolarHBondContact O-CG 3.36Å; I407-L411 PolarHBondContact O-N 3.49Å
408	A	82	Confident	82.6	Confident	16 Å²	16	62.6 Å²	62.6	13%	0.132	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-37.2	179.7	0	0	0	0	0	113.3	F398 L404 Q405 Q406 S412	F398-A408 HydrophobicContact CE2-CB 3.56Å; F398-A408 HydrophobicContact CZ-CB 4.18Å; L404-A408 WeakPolarHBondContact O-CB 3.36Å; L404-A408 PolarHBondContact O-N 3.47Å; Q405-A408 PolarHBondContact O-N 3.34Å; Q406-A408 VanDerWaalsContact C-N 3.32Å; Q406-A408 PolarHBondContact O-N 3.4Å; A408-S412 WeakPolarHBondContact O-CB 3.5Å; A408-S412 PolarHBondContact O-N 2.82Å; A408-S412 PolarHBondContact O-OG 3.27Å
409	V	86.2	Confident	83	Confident	106 Å²	106	61.2 Å²	61.2	64%	0.642	35%	0.347	S	S	*	.	H	α-helix	trans	-63.7	-45.2	173.9	170	0	0	0	0	110.7	Q405 Q406 I407 S412 G413	Q405-V409 WeakPolarHBondContact O-CG2 3.49Å; Q405-V409 PolarHBondContact O-N 3.43Å; Q406-V409 PolarHBondContact O-N 2.81Å; I407-V409 PolarHBondContact O-N 3.42Å; V409-S412 PolarHBondContact O-N 2.74Å; V409-G413 PolarHBondContact O-N 3.42Å
410	I	87	Confident	83.5	Confident	51 Å²	51	57.7 Å²	57.7	26%	0.262	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-47.8	178.4	-66.7	166.3	0	0	0	110.7	F375 P379 Q406 I407 S412 G413 L414	F375-I410 HydrophobicContact CE1-CD1 3.84Å; F375-I410 HydrophobicContact CE2-CG2 4.39Å; F375-I410 HydrophobicContact CZ-CB 4.05Å; F375-I410 HydrophobicContact CZ-CD1 4.04Å; F375-I410 HydrophobicContact CZ-CG2 3.69Å; P379-I410 HydrophobicContact CB-CG2 3.87Å; Q406-I410 HydrophobicContact CG-CD1 4.06Å; Q406-I410 WeakPolarHBondContact O-CG1 3.42Å; Q406-I410 PolarHBondContact O-N 3.3Å; I407-I410 PolarHBondContact O-N 2.8Å; I410-S412 PolarHBondContact O-N 2.86Å; I410-G413 CarbonylContact O-C 3.58Å; I410-G413 WeakPolarHBondContact O-CA 3.28Å; I410-G413 PolarHBondContact O-N 3.14Å; I410-G413 VanDerWaalsContact O-N 3.13Å; I410-L414 HydrophobicContact CG2-CD1 4.39Å; I410-L414 WeakPolarHBondContact O-CG 3.4Å; I410-L414 PolarHBondContact O-N 3.01Å
411	L	84.6	Confident	83.8	Confident	2 Å²	2	54 Å²	54	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-42.2	178.5	-73.9	179.9	0	0	0	112.3	E381 I385 I407 G413 L414 L415 I436	E381-L411 HydrophobicContact CB-CD2 4.5Å; I385-L411 HydrophobicContact CG1-CD1 4.07Å; I407-L411 HydrophobicContact CG2-CD1 3.68Å; I407-L411 HydrophobicContact CG2-CG 4.07Å; I407-L411 WeakPolarHBondContact O-CB 3.32Å; I407-L411 VanDerWaalsContact O-CG 3.28Å; I407-L411 WeakPolarHBondContact O-CG 3.36Å; I407-L411 PolarHBondContact O-N 3.49Å; L411-G413 VanDerWaalsContact C-N 3.28Å; L411-G413 PolarHBondContact O-N 3.2Å; L411-L414 HydrophobicContact CD2-CD1 4.47Å; L411-L414 PolarHBondContact O-N 3.16Å; L411-L415 PolarHBondContact O-N 3.46Å; L411-I436 HydrophobicContact CB-CD1 3.62Å; L411-I436 HydrophobicContact CB-CG1 4.15Å; L411-I436 HydrophobicContact CD1-CD1 4.04Å; L411-I436 HydrophobicContact CD1-CG1 3.88Å; L411-I436 HydrophobicContact CD2-CD1 4.46Å; L411-I436 HydrophobicContact CG-CD1 4.27Å
412	S	80.8	Confident	83.6	Confident	64 Å²	64	57.2 Å²	57.2	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-63.4	-36.4	173.8	-59.4	0	0	0	0	111.5	A408 V409 I410 G416	A408-S412 WeakPolarHBondContact O-CB 3.5Å; A408-S412 PolarHBondContact O-N 2.82Å; A408-S412 PolarHBondContact O-OG 3.27Å; V409-S412 PolarHBondContact O-N 2.74Å; I410-S412 PolarHBondContact O-N 2.86Å; S412-G416 PolarHBondContact O-N 2.81Å
413	G	84.7	Confident	83.3	Confident	38 Å²	38	58.1 Å²	58.1	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-66.9	-38.5	173.6	0	0	0	0	0	113.4	V409 I410 L411 R417	V409-G413 PolarHBondContact O-N 3.42Å; I410-G413 CarbonylContact O-C 3.58Å; I410-G413 WeakPolarHBondContact O-CA 3.28Å; I410-G413 PolarHBondContact O-N 3.14Å; I410-G413 VanDerWaalsContact O-N 3.13Å; L411-G413 VanDerWaalsContact C-N 3.28Å; L411-G413 PolarHBondContact O-N 3.2Å; G413-R417 WeakPolarHBondContact O-CG 3.36Å; G413-R417 PolarHBondContact O-N 3.09Å
414	L	83	Confident	82.9	Confident	25 Å²	25	56.3 Å²	56.3	13%	0.131	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-45.9	174.6	-70	175.4	0	0	0	111.3	E381 I410 L411 R417	E381-L414 HydrophobicContact CG-CB 4.19Å; E381-L414 HydrophobicContact CG-CD1 4.09Å; I410-L414 HydrophobicContact CG2-CD1 4.39Å; I410-L414 WeakPolarHBondContact O-CG 3.4Å; I410-L414 PolarHBondContact O-N 3.01Å; L411-L414 HydrophobicContact CD2-CD1 4.47Å; L411-L414 PolarHBondContact O-N 3.16Å; L414-R417 PolarHBondContact O-N 3.4Å
415	L	79.5	Confident	82.5	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-67	-37.2	175.4	-80.7	171	0	0	0	113.1	L411 R417 K418 M424 D429 T432 F433 I436	L411-L415 PolarHBondContact O-N 3.46Å; L415-R417 PolarHBondContact O-N 3.28Å; L415-K418 WeakPolarHBondContact O-CA 3.48Å; L415-K418 VanDerWaalsContact O-CB 3.32Å; L415-K418 WeakPolarHBondContact O-CB 3.4Å; L415-K418 PolarHBondContact O-N 3.18Å; L415-M424 HydrophobicContact CD2-CE 4.28Å; L415-D429 WeakPolarHBondContact CD2-O 3.23Å; L415-T432 HydrophobicContact CD1-CG2 4.19Å; L415-T432 HydrophobicContact CD2-CG2 3.94Å; L415-T432 HydrophobicContact CG-CG2 4.21Å; L415-F433 HydrophobicContact CD1-CB 3.84Å; L415-F433 HydrophobicContact CD1-CD2 4.08Å; L415-F433 HydrophobicContact CD1-CG 4.38Å; L415-F433 HydrophobicContact CD2-CB 4.31Å; L415-I436 HydrophobicContact CD1-CD1 3.34Å; L415-I436 HydrophobicContact CG-CD1 4.3Å
416	G	78	Confident	81.9	Confident	52 Å²	52	64.6 Å²	64.6	54%	0.536	37%	0.366	S	S	.	.	H	α-helix	trans	-60	-31.2	178.4	0	0	0	0	0	113	S412 K418 G419	S412-G416 PolarHBondContact O-N 2.81Å; G416-K418 PolarHBondContact O-N 3.34Å; G416-G419 PolarHBondContact O-N 3.35Å
417	R	80.7	Confident	81.2	Confident	203 Å²	203	59.1 Å²	59.1	77%	0.766	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.4	173.1	-64.3	178.9	-152.3	165.4	5.5	112.9	G413 L414 L415	G413-R417 WeakPolarHBondContact O-CG 3.36Å; G413-R417 PolarHBondContact O-N 3.09Å; L414-R417 PolarHBondContact O-N 3.4Å; L415-R417 PolarHBondContact O-N 3.28Å
418	K	78	Confident	80.6	Confident	82 Å²	82	63 Å²	63	36%	0.357	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-7	179.6	-54.4	-172.8	175.4	173	0	113	E381 L415 G416 M424 D429	E381-K418 WeakPolarHBondContact OE1-CE 3.45Å; E381-K418 IonicContact OE1-NZ 3.52Å; E381-K418 PolarHBondContact OE1-NZ 2.96Å; E381-K418 IonicContact OE2-NZ 3.8Å; E381-K418 PolarHBondContact OE2-NZ 2.9Å; L415-K418 WeakPolarHBondContact O-CA 3.48Å; L415-K418 VanDerWaalsContact O-CB 3.32Å; L415-K418 WeakPolarHBondContact O-CB 3.4Å; L415-K418 PolarHBondContact O-N 3.18Å; G416-K418 PolarHBondContact O-N 3.34Å; K418-M424 HydrophobicContact CB-CE 4.43Å; K418-D429 HydrophobicContact CD-CB 4.09Å; K418-D429 VanDerWaalsContact CD-OD1 3.28Å; K418-D429 WeakPolarHBondContact CD-OD1 3.18Å; K418-D429 WeakPolarHBondContact CD-OD2 3.36Å; K418-D429 WeakPolarHBondContact CE-OD1 3.39Å; K418-D429 IonicContact NZ-OD1 2.93Å; K418-D429 PolarHBondContact NZ-OD1 2.88Å
419	G	80.6	Confident	80.4	Confident	34 Å²	34	63.3 Å²	63.3	35%	0.351	35%	0.354	S	S	.	.			trans	107.5	-173.5	174.4	0	0	0	0	0	114.2	G416 M424	G416-G419 PolarHBondContact O-N 3.35Å; G419-M424 VanDerWaalsContact O-CE 3.28Å; G419-M424 WeakPolarHBondContact O-CE 3.35Å
420	S	83.3	Confident	80.2	Confident	58 Å²	58	58.2 Å²	58.2	41%	0.406	32%	0.323	S	S	.	.			trans	-75.9	153.5	176	61.8	0	0	0	0	111.6	S422 N423 M424	S420-S422 PolarHBondContact O-N 3.5Å; S420-S422 VanDerWaalsContact O-N 3.11Å; S420-S422 PolarHBondContact OG-OG 3.1Å; S420-N423 PolarHBondContact O-N 2.84Å; S420-N423 VanDerWaalsContact OG-CG 3.26Å; S420-N423 PolarHBondContact OG-ND2 3.08Å; S420-M424 WeakPolarHBondContact O-CG 3.25Å; S420-M424 PolarHBondContact O-N 2.74Å; S420-M424 VanDerWaalsContact O-N 3.11Å
421	L	83.1	Confident	79.8	Confident	31 Å²	31	55.8 Å²	55.8	16%	0.162	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.1	179	-176.6	65.1	0	0	0	113.5	N423 M424 V430 F433 Q448 A449 R452	L421-N423 VanDerWaalsContact C-N 3.25Å; L421-N423 PolarHBondContact O-N 3.48Å; L421-M424 HydrophobicContact CD1-SD 4.36Å; L421-V430 HydrophobicContact CD1-CG1 3.91Å; L421-F433 HydrophobicContact CD1-CD1 3.83Å; L421-F433 HydrophobicContact CD1-CE1 4.13Å; L421-F433 HydrophobicContact CD1-CG 4.19Å; L421-F433 HydrophobicContact CD2-CD1 4.4Å; L421-F433 HydrophobicContact CD2-CE1 3.91Å; L421-F433 HydrophobicContact CD2-CZ 4.46Å; L421-F433 HydrophobicContact CG-CE1 4.46Å; L421-Q448 HydrophobicContact CD2-CB 3.63Å; L421-A449 HydrophobicContact CD1-CB 3.96Å; L421-A449 HydrophobicContact CD2-CB 4.17Å; L421-R452 HydrophobicContact CD1-CB 4.41Å
422	S	81.1	Confident	79.4	Confident	76 Å²	76	56.1 Å²	56.1	53%	0.531	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-29.6	176.7	59.4	0	0	0	0	113.5	S420 R452	S420-S422 PolarHBondContact O-N 3.5Å; S420-S422 VanDerWaalsContact O-N 3.11Å; S420-S422 PolarHBondContact OG-OG 3.1Å; S422-R452 PolarHBondContact O-NH2 2.92Å
423	N	81.4	Confident	79.6	Confident	112 Å²	112	55.1 Å²	55.1	60%	0.599	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-16.2	-172	-63.7	-0.6	0	0	0	112.5	S420 L421 Q425	S420-N423 PolarHBondContact O-N 2.84Å; S420-N423 VanDerWaalsContact OG-CG 3.26Å; S420-N423 PolarHBondContact OG-ND2 3.08Å; L421-N423 VanDerWaalsContact C-N 3.25Å; L421-N423 PolarHBondContact O-N 3.48Å; N423-Q425 PolarHBondContact O-N 3.25Å
424	M	81.1	Confident	79.5	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.025	28%	0.283	C	S	.	.			trans	-61.2	124.7	175.7	-70.2	177.6	179.5	0	0	110.5	L415 K418 G419 S420 L421 D429 V430 R452	L415-M424 HydrophobicContact CD2-CE 4.28Å; K418-M424 HydrophobicContact CB-CE 4.43Å; G419-M424 VanDerWaalsContact O-CE 3.28Å; G419-M424 WeakPolarHBondContact O-CE 3.35Å; S420-M424 WeakPolarHBondContact O-CG 3.25Å; S420-M424 PolarHBondContact O-N 2.74Å; S420-M424 VanDerWaalsContact O-N 3.11Å; L421-M424 HydrophobicContact CD1-SD 4.36Å; M424-D429 HydrophobicContact SD-CB 4.15Å; M424-V430 HydrophobicContact CB-CG2 3.59Å; M424-V430 HydrophobicContact SD-CG2 4.21Å; M424-R452 PolarHBondContact O-NE 3.42Å; M424-R452 VanDerWaalsContact O-NE 3.08Å; M424-R452 PolarHBondContact O-NH2 2.86Å
425	Q	77.3	Confident	79.3	Confident	161 Å²	161	52.6 Å²	52.6	75%	0.752	28%	0.278	S	S	*	.			trans	-105.4	-24.8	176.8	-61.8	-175.1	15.4	0	0	112.1	N423 L456	N423-Q425 PolarHBondContact O-N 3.25Å; Q425-L456 WeakPolarHBondContact O-CD2 3.35Å
426	D	74.1	Confident	79.3	Confident	101 Å²	101	52.9 Å²	52.9	54%	0.54	28%	0.279	S	S	.	.			trans	-80.9	120	179.1	-71.9	-44.6	0	0	0	110.8	W428 D429 V430	D426-W428 PolarHBondContact O-N 3Å; D426-D429 HydrophobicContact CB-CB 4.41Å; D426-D429 WeakPolarHBondContact CB-OD2 3.38Å; D426-D429 PolarHBondContact O-N 3.47Å; D426-D429 VanDerWaalsContact O-N 3.13Å; D426-V430 PolarHBondContact O-N 2.74Å
427	Y	73.3	Confident	79.5	Confident	13 Å²	13	50.7 Å²	50.7	5%	0.051	26%	0.256	C	S	.	.	H	α-helix	trans	-56	-37.7	-179.2	-173.2	-87.3	0	0	0	112.7	D429 V430 A431 M453 L456 P458 L490	Y427-D429 VanDerWaalsContact C-N 3.31Å; Y427-D429 PolarHBondContact O-N 3.15Å; Y427-V430 PolarHBondContact O-N 3.05Å; Y427-A431 HydrophobicContact CD1-CB 4.22Å; Y427-A431 HydrophobicContact CE1-CB 4.05Å; Y427-A431 VanDerWaalsContact O-CB 3.28Å; Y427-A431 WeakPolarHBondContact O-CB 3.43Å; Y427-A431 PolarHBondContact O-N 3.13Å; Y427-M453 HydrophobicContact CD2-CB 4.49Å; Y427-M453 HydrophobicContact CE1-CE 4.09Å; Y427-M453 HydrophobicContact CE2-CB 3.72Å; Y427-M453 HydrophobicContact CE2-CE 4.35Å; Y427-M453 HydrophobicContact CE2-CG 4.06Å; Y427-M453 WeakPolarHBondContact CE2-O 3.45Å; Y427-M453 WeakPolarHBondContact OH-CE 3.39Å; Y427-L456 HydrophobicContact CD2-CB 4.36Å; Y427-P458 HydrophobicContact CD2-CB 4.11Å; Y427-P458 HydrophobicContact CD2-CG 4.41Å; Y427-P458 HydrophobicContact CE2-CB 3.41Å; Y427-P458 VanDerWaalsContact CE2-CB 3.41Å; Y427-P458 HydrophobicContact CE2-CG 3.49Å; Y427-P458 VanDerWaalsContact CE2-CG 3.49Å; Y427-L490 HydrophobicContact CD1-CD2 3.22Å; Y427-L490 HydrophobicContact CE1-CD2 3.8Å; Y427-L490 HydrophobicContact CG-CD2 3.89Å
428	W	73.4	Confident	79.4	Confident	89 Å²	89	41.1 Å²	41.1	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-60.3	-40.9	179.6	-59.6	99.9	0	0	0	112.3	D426 A431 T432 R489 L490 F493	D426-W428 PolarHBondContact O-N 3Å; W428-A431 PolarHBondContact O-N 3.44Å; W428-T432 VanDerWaalsContact O-CB 3.23Å; W428-T432 WeakPolarHBondContact O-CB 3.34Å; W428-T432 PolarHBondContact O-N 2.89Å; W428-T432 PolarHBondContact O-OG1 3.3Å; W428-R489 HydrophobicContact CH2-CB 4.42Å; W428-R489 HydrophobicContact CH2-CG 3.94Å; W428-R489 HydrophobicContact CZ2-CB 4.4Å; W428-R489 HydrophobicContact CZ2-CG 4.17Å; W428-L490 HydrophobicContact CD2-CD2 4.17Å; W428-L490 HydrophobicContact CH2-CD2 4.14Å; W428-L490 HydrophobicContact CH2-CG 4.23Å; W428-L490 HydrophobicContact CZ2-CD2 3.59Å; W428-L490 HydrophobicContact CZ2-CG 3.59Å; W428-F493 HydrophobicContact CE3-CB 4.06Å; W428-F493 AromaticContact CE3-CD1 3.81Å; W428-F493 HydrophobicContact CE3-CD1 3.81Å; W428-F493 AromaticContact CE3-CD2 3.69Å; W428-F493 HydrophobicContact CE3-CD2 3.69Å; W428-F493 HydrophobicContact CE3-CE1 4.15Å; W428-F493 HydrophobicContact CE3-CE2 4Å; W428-F493 AromaticContact CE3-CG 3.55Å; W428-F493 HydrophobicContact CE3-CG 3.55Å; W428-F493 HydrophobicContact CE3-CZ 4.22Å; W428-F493 HydrophobicContact CH2-CB 3.57Å; W428-F493 HydrophobicContact CH2-CD2 4.41Å; W428-F493 HydrophobicContact CH2-CG 4.03Å; W428-F493 HydrophobicContact CZ3-CB 3.18Å; W428-F493 AromaticContact CZ3-CD1 3.83Å; W428-F493 HydrophobicContact CZ3-CD1 3.83Å; W428-F493 AromaticContact CZ3-CD2 3.28Å; W428-F493 HydrophobicContact CZ3-CD2 3.28Å; W428-F493 HydrophobicContact CZ3-CE2 4.03Å; W428-F493 AromaticContact CZ3-CG 3.11Å; W428-F493 HydrophobicContact CZ3-CG 3.11Å
429	D	77.4	Confident	79.3	Confident	21 Å²	21	37.9 Å²	37.9	11%	0.112	21%	0.206	C	C	.	.	H	α-helix	trans	-69.5	-42.2	-179.4	-61.8	-21.5	0	0	0	110.7	L415 K418 M424 D426 Y427 T432 F433	L415-D429 WeakPolarHBondContact CD2-O 3.23Å; K418-D429 HydrophobicContact CD-CB 4.09Å; K418-D429 VanDerWaalsContact CD-OD1 3.28Å; K418-D429 WeakPolarHBondContact CD-OD1 3.18Å; K418-D429 WeakPolarHBondContact CD-OD2 3.36Å; K418-D429 WeakPolarHBondContact CE-OD1 3.39Å; K418-D429 IonicContact NZ-OD1 2.93Å; K418-D429 PolarHBondContact NZ-OD1 2.88Å; M424-D429 HydrophobicContact SD-CB 4.15Å; D426-D429 HydrophobicContact CB-CB 4.41Å; D426-D429 WeakPolarHBondContact CB-OD2 3.38Å; D426-D429 PolarHBondContact O-N 3.47Å; D426-D429 VanDerWaalsContact O-N 3.13Å; Y427-D429 VanDerWaalsContact C-N 3.31Å; Y427-D429 PolarHBondContact O-N 3.15Å; D429-T432 PolarHBondContact O-N 3.3Å; D429-F433 WeakPolarHBondContact O-CB 3.5Å; D429-F433 PolarHBondContact O-N 2.87Å
430	V	82.4	Confident	79.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-41	176.7	-174.2	0	0	0	0	111.1	L421 M424 D426 Y427 F433 F434 A449 R452 M453 L456	L421-V430 HydrophobicContact CD1-CG1 3.91Å; M424-V430 HydrophobicContact CB-CG2 3.59Å; M424-V430 HydrophobicContact SD-CG2 4.21Å; D426-V430 PolarHBondContact O-N 2.74Å; Y427-V430 PolarHBondContact O-N 3.05Å; V430-F433 WeakPolarHBondContact O-CB 3.33Å; V430-F433 PolarHBondContact O-N 2.99Å; V430-F434 WeakPolarHBondContact O-CB 3.48Å; V430-F434 PolarHBondContact O-N 3.14Å; V430-A449 HydrophobicContact CG1-CB 4.32Å; V430-A449 WeakPolarHBondContact CG1-O 3.33Å; V430-R452 HydrophobicContact CG1-CB 3.76Å; V430-R452 HydrophobicContact CG1-CG 3.79Å; V430-R452 HydrophobicContact CG2-CG 3.92Å; V430-M453 HydrophobicContact CB-CG 4.16Å; V430-M453 HydrophobicContact CG1-CG 3.58Å; V430-L456 HydrophobicContact CB-CD1 4.26Å; V430-L456 HydrophobicContact CG2-CD1 3.51Å
431	A	78	Confident	78.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-73.2	-32.6	179.4	0	0	0	0	0	112.4	Y427 W428 F434 E435 M453 F493	Y427-A431 HydrophobicContact CD1-CB 4.22Å; Y427-A431 HydrophobicContact CE1-CB 4.05Å; Y427-A431 VanDerWaalsContact O-CB 3.28Å; Y427-A431 WeakPolarHBondContact O-CB 3.43Å; Y427-A431 PolarHBondContact O-N 3.13Å; W428-A431 PolarHBondContact O-N 3.44Å; A431-F434 WeakPolarHBondContact O-CB 3.41Å; A431-F434 PolarHBondContact O-N 3.3Å; A431-E435 PolarHBondContact O-N 3.49Å; A431-M453 HydrophobicContact CB-CE 3.78Å; A431-M453 HydrophobicContact CB-CG 4.48Å; A431-M453 HydrophobicContact CB-SD 4.02Å; A431-F493 HydrophobicContact CB-CD1 4.14Å; A431-F493 HydrophobicContact CB-CE1 3.49Å; A431-F493 VanDerWaalsContact CB-CE1 3.49Å
432	T	76.4	Confident	78.6	Confident	9 Å²	9	39 Å²	39	6%	0.055	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-46.5	168.4	-60.7	0	0	0	0	110.4	E381 I385 L415 W428 D429 F434 E435 I436	E381-T432 HydrophobicContact CB-CG2 4.07Å; E381-T432 HydrophobicContact CG-CG2 4.2Å; I385-T432 HydrophobicContact CD1-CG2 3.55Å; L415-T432 HydrophobicContact CD1-CG2 4.19Å; L415-T432 HydrophobicContact CD2-CG2 3.94Å; L415-T432 HydrophobicContact CG-CG2 4.21Å; W428-T432 VanDerWaalsContact O-CB 3.23Å; W428-T432 WeakPolarHBondContact O-CB 3.34Å; W428-T432 PolarHBondContact O-N 2.89Å; W428-T432 PolarHBondContact O-OG1 3.3Å; D429-T432 PolarHBondContact O-N 3.3Å; T432-F434 VanDerWaalsContact C-N 3.28Å; T432-F434 PolarHBondContact O-N 2.64Å; T432-E435 PolarHBondContact O-N 3.46Å; T432-I436 HydrophobicContact CG2-CD1 3.95Å; T432-I436 WeakPolarHBondContact O-CD1 3.49Å; T432-I436 WeakPolarHBondContact O-CG1 3.47Å; T432-I436 PolarHBondContact O-N 3.37Å
433	F	83.8	Confident	78.7	Confident	43 Å²	43	35.6 Å²	35.6	19%	0.189	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-38.7	174.4	-177.2	-79.9	0	0	0	112	L415 L421 D429 V430 S437 N445 A449	L415-F433 HydrophobicContact CD1-CB 3.84Å; L415-F433 HydrophobicContact CD1-CD2 4.08Å; L415-F433 HydrophobicContact CD1-CG 4.38Å; L415-F433 HydrophobicContact CD2-CB 4.31Å; L421-F433 HydrophobicContact CD1-CD1 3.83Å; L421-F433 HydrophobicContact CD1-CE1 4.13Å; L421-F433 HydrophobicContact CD1-CG 4.19Å; L421-F433 HydrophobicContact CD2-CD1 4.4Å; L421-F433 HydrophobicContact CD2-CE1 3.91Å; L421-F433 HydrophobicContact CD2-CZ 4.46Å; L421-F433 HydrophobicContact CG-CE1 4.46Å; D429-F433 WeakPolarHBondContact O-CB 3.5Å; D429-F433 PolarHBondContact O-N 2.87Å; V430-F433 WeakPolarHBondContact O-CB 3.33Å; V430-F433 PolarHBondContact O-N 2.99Å; F433-S437 WeakPolarHBondContact CE1-OG 3.4Å; F433-S437 WeakPolarHBondContact O-CB 3.37Å; F433-S437 PolarHBondContact O-N 3.5Å; F433-S437 PolarHBondContact O-OG 3.4Å; F433-N445 HydrophobicContact CE1-CB 4Å; F433-N445 HydrophobicContact CZ-CB 4.25Å; F433-A449 HydrophobicContact CD1-CB 3.62Å; F433-A449 HydrophobicContact CE1-CB 4.12Å
434	F	83.7	Confident	78.8	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-51.5	174.6	179.1	-110.8	0	0	0	111.5	V430 A431 T432 I436 S437 V438 A446 A449 A450 M453 T497 I501 F525 M529	V430-F434 WeakPolarHBondContact O-CB 3.48Å; V430-F434 PolarHBondContact O-N 3.14Å; A431-F434 WeakPolarHBondContact O-CB 3.41Å; A431-F434 PolarHBondContact O-N 3.3Å; T432-F434 VanDerWaalsContact C-N 3.28Å; T432-F434 PolarHBondContact O-N 2.64Å; F434-I436 PolarHBondContact O-N 2.76Å; F434-S437 WeakPolarHBondContact O-CB 3.47Å; F434-S437 PolarHBondContact O-N 3.03Å; F434-V438 HydrophobicContact CE1-CG2 4.31Å; F434-V438 HydrophobicContact CE2-CG2 4.13Å; F434-V438 HydrophobicContact CZ-CG2 3.94Å; F434-V438 WeakPolarHBondContact O-CG2 3.23Å; F434-V438 PolarHBondContact O-N 2.83Å; F434-A446 HydrophobicContact CD2-CB 4.01Å; F434-A446 WeakPolarHBondContact CD2-O 3.24Å; F434-A446 HydrophobicContact CE2-CB 3.75Å; F434-A446 VanDerWaalsContact CE2-O 3.25Å; F434-A446 WeakPolarHBondContact CE2-O 3.32Å; F434-A449 HydrophobicContact CB-CB 3.91Å; F434-A449 HydrophobicContact CD2-CB 4.12Å; F434-A450 HydrophobicContact CD2-CB 4.22Å; F434-A450 HydrophobicContact CE2-CB 3.94Å; F434-M453 HydrophobicContact CB-SD 3.75Å; F434-M453 HydrophobicContact CD1-SD 4.07Å; F434-M453 HydrophobicContact CG-SD 3.85Å; F434-T497 HydrophobicContact CD1-CG2 4.19Å; F434-I501 HydrophobicContact CD1-CD1 3.94Å; F434-I501 HydrophobicContact CE1-CD1 3.29Å; F434-I501 HydrophobicContact CZ-CD1 4.1Å; F434-F525 HydrophobicContact CE2-CD2 4.25Å; F434-F525 HydrophobicContact CE2-CE2 4.17Å; F434-F525 HydrophobicContact CZ-CD2 4.16Å; F434-F525 AromaticContact CZ-CE2 3.71Å; F434-F525 HydrophobicContact CZ-CE2 3.71Å; F434-M529 HydrophobicContact CE1-CE 3.64Å; F434-M529 HydrophobicContact CE2-CE 4.36Å; F434-M529 HydrophobicContact CZ-CE 3.23Å; F434-M529 HydrophobicContact CZ-SD 4.39Å
435	E	78.1	Confident	79.1	Confident	7 Å²	7	37.4 Å²	37.4	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-44.6	177.4	-76.5	-173.6	-127.6	0	0	112.7	I385 A431 T432 S437 V438 L439 T497 N500	I385-E435 HydrophobicContact CD1-CB 4.37Å; I385-E435 HydrophobicContact CG2-CB 4.48Å; I385-E435 WeakPolarHBondContact CG2-OE2 3.4Å; A431-E435 PolarHBondContact O-N 3.49Å; T432-E435 PolarHBondContact O-N 3.46Å; E435-S437 PolarHBondContact O-N 3.4Å; E435-V438 PolarHBondContact O-N 3.32Å; E435-L439 WeakPolarHBondContact O-CB 3.34Å; E435-L439 WeakPolarHBondContact O-CG 3.29Å; E435-L439 PolarHBondContact O-N 3.3Å; E435-T497 HydrophobicContact CG-CG2 3.4Å; E435-T497 WeakPolarHBondContact OE1-CA 3.35Å; E435-T497 WeakPolarHBondContact OE1-CB 3.37Å; E435-T497 VanDerWaalsContact OE1-CG2 3.29Å; E435-T497 WeakPolarHBondContact OE1-CG2 3.39Å; E435-T497 PolarHBondContact OE1-OG1 3.12Å; E435-N500 PolarHBondContact OE2-ND2 2.94Å
436	I	80	Confident	79.5	Confident	11 Å²	11	29.7 Å²	29.7	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-39.6	178.4	-71.6	155.6	0	0	0	111.4	I385 L411 L415 T432 F434 V438 L439 A440	I385-I436 HydrophobicContact CD1-CD1 4.33Å; I385-I436 HydrophobicContact CD1-CG1 4.39Å; I385-I436 HydrophobicContact CG1-CD1 4.42Å; I385-I436 HydrophobicContact CG1-CG1 4.19Å; L411-I436 HydrophobicContact CB-CD1 3.62Å; L411-I436 HydrophobicContact CB-CG1 4.15Å; L411-I436 HydrophobicContact CD1-CD1 4.04Å; L411-I436 HydrophobicContact CD1-CG1 3.88Å; L411-I436 HydrophobicContact CD2-CD1 4.46Å; L411-I436 HydrophobicContact CG-CD1 4.27Å; L415-I436 HydrophobicContact CD1-CD1 3.34Å; L415-I436 HydrophobicContact CG-CD1 4.3Å; T432-I436 HydrophobicContact CG2-CD1 3.95Å; T432-I436 WeakPolarHBondContact O-CD1 3.49Å; T432-I436 WeakPolarHBondContact O-CG1 3.47Å; T432-I436 PolarHBondContact O-N 3.37Å; F434-I436 PolarHBondContact O-N 2.76Å; I436-V438 VanDerWaalsContact C-N 3.31Å; I436-V438 PolarHBondContact O-N 2.93Å; I436-L439 PolarHBondContact O-N 3.2Å; I436-A440 WeakPolarHBondContact O-CB 3.2Å; I436-A440 PolarHBondContact O-N 2.96Å
437	S	82.5	Confident	80.1	Confident	7 Å²	7	25 Å²	25	5%	0.049	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-39.8	175.8	-61	0	0	0	0	111.5	F433 F434 E435 A440 E441 N442	F433-S437 WeakPolarHBondContact CE1-OG 3.4Å; F433-S437 WeakPolarHBondContact O-CB 3.37Å; F433-S437 PolarHBondContact O-N 3.5Å; F433-S437 PolarHBondContact O-OG 3.4Å; F434-S437 WeakPolarHBondContact O-CB 3.47Å; F434-S437 PolarHBondContact O-N 3.03Å; E435-S437 PolarHBondContact O-N 3.4Å; S437-A440 PolarHBondContact O-N 3.19Å; S437-E441 PolarHBondContact O-N 2.93Å; S437-N442 PolarHBondContact O-N 2.91Å
438	V	78.9	Confident	80.9	Confident	1 Å²	1	28 Å²	28	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-47.5	174.1	177.1	0	0	0	0	110.7	F434 E435 I436 A440 E441 A446 I501 R508 F525	F434-V438 HydrophobicContact CE1-CG2 4.31Å; F434-V438 HydrophobicContact CE2-CG2 4.13Å; F434-V438 HydrophobicContact CZ-CG2 3.94Å; F434-V438 WeakPolarHBondContact O-CG2 3.23Å; F434-V438 PolarHBondContact O-N 2.83Å; E435-V438 PolarHBondContact O-N 3.32Å; I436-V438 VanDerWaalsContact C-N 3.31Å; I436-V438 PolarHBondContact O-N 2.93Å; V438-A440 PolarHBondContact O-N 2.87Å; V438-E441 PolarHBondContact O-N 3.38Å; V438-A446 HydrophobicContact CG2-CB 4Å; V438-I501 HydrophobicContact CB-CG1 4.49Å; V438-I501 HydrophobicContact CG1-CG1 4.15Å; V438-I501 HydrophobicContact CG1-CG2 4.14Å; V438-I501 HydrophobicContact CG2-CD1 4.25Å; V438-R508 PolarHBondContact O-NH1 3.37Å; V438-R508 PolarHBondContact O-NH2 3.15Å; V438-F525 HydrophobicContact CG1-CE2 4.36Å; V438-F525 HydrophobicContact CG1-CZ 4.07Å; V438-F525 HydrophobicContact CG2-CD2 4.23Å; V438-F525 HydrophobicContact CG2-CE2 3.38Å; V438-F525 HydrophobicContact CG2-CZ 3.94Å
439	L	76.2	Confident	81.6	Confident	14 Å²	14	23.8 Å²	23.8	7%	0.073	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-37.1	176.2	-78.2	166.3	0	0	0	112.5	A388 V392 E435 I436 E441 I504 R508	A388-L439 HydrophobicContact CB-CD1 3.79Å; A388-L439 HydrophobicContact CB-CD2 4.22Å; V392-L439 HydrophobicContact CG2-CD2 4.06Å; E435-L439 WeakPolarHBondContact O-CB 3.34Å; E435-L439 WeakPolarHBondContact O-CG 3.29Å; E435-L439 PolarHBondContact O-N 3.3Å; I436-L439 PolarHBondContact O-N 3.2Å; L439-E441 VanDerWaalsContact C-N 3.31Å; L439-E441 PolarHBondContact O-N 3.07Å; L439-I504 HydrophobicContact CD2-CD1 3.46Å; L439-I504 VanDerWaalsContact CD2-CD1 3.46Å; L439-I504 HydrophobicContact CD2-CG1 4.19Å; L439-I504 HydrophobicContact CG-CD1 3.99Å; L439-R508 VanDerWaalsContact C-NH2 3.31Å; L439-R508 PolarHBondContact O-NH2 3.46Å
440	A	75.9	Confident	82	Confident	33 Å²	33	22.8 Å²	22.8	27%	0.273	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	2.8	177	0	0	0	0	0	114.6	F398 I436 S437 V438 N442	F398-A440 HydrophobicContact CE2-CB 4.42Å; I436-A440 WeakPolarHBondContact O-CB 3.2Å; I436-A440 PolarHBondContact O-N 2.96Å; S437-A440 PolarHBondContact O-N 3.19Å; V438-A440 PolarHBondContact O-N 2.87Å; A440-N442 PolarHBondContact O-N 2.8Å; A440-N442 VanDerWaalsContact O-N 3.15Å
441	E	74	Confident	82.3	Confident	49 Å²	49	24.7 Å²	24.7	23%	0.229	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	21.7	-175.9	-63.1	176.4	-179.2	0	0	113.9	S437 V438 L439 Y443 R508	S437-E441 PolarHBondContact O-N 2.93Å; V438-E441 PolarHBondContact O-N 3.38Å; L439-E441 VanDerWaalsContact C-N 3.31Å; L439-E441 PolarHBondContact O-N 3.07Å; E441-Y443 HydrophobicContact CB-CE2 4.18Å; E441-Y443 WeakPolarHBondContact O-CD2 3.38Å; E441-Y443 PolarHBondContact O-N 3.38Å; E441-R508 VanDerWaalsContact CG-CZ 3.44Å; E441-R508 IonicContact OE1-CZ 3.24Å; E441-R508 IonicContact OE1-NE 2.77Å; E441-R508 PolarHBondContact OE1-NE 3.43Å
442	N	80.9	Confident	82.7	Confident	65 Å²	65	27.2 Å²	27.2	35%	0.348	13%	0.134	S	C	.	.			trans	-91.9	79.5	176	-170.3	-19.7	0	0	0	110.2	S437 A440 F444 N445 A446	S437-N442 PolarHBondContact O-N 2.91Å; A440-N442 PolarHBondContact O-N 2.8Å; A440-N442 VanDerWaalsContact O-N 3.15Å; N442-F444 VanDerWaalsContact C-N 3.27Å; N442-F444 PolarHBondContact O-N 3.23Å; N442-N445 HydrophobicContact CB-CB 4.44Å; N442-N445 PolarHBondContact ND2-ND2 2.88Å; N442-N445 VanDerWaalsContact ND2-ND2 3.13Å; N442-N445 PolarHBondContact O-N 3.11Å; N442-N445 PolarHBondContact OD1-N 3.11Å; N442-N445 VanDerWaalsContact OD1-N 3.16Å; N442-A446 PolarHBondContact O-N 3.34Å
443	Y	82.7	Confident	83.1	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-28.1	-176.8	-62.1	-70.3	0	0	0	113.5	E441 A446 C447 R508 Y514 Y522 F525	E441-Y443 HydrophobicContact CB-CE2 4.18Å; E441-Y443 WeakPolarHBondContact O-CD2 3.38Å; E441-Y443 PolarHBondContact O-N 3.38Å; Y443-A446 PolarHBondContact O-N 3.42Å; Y443-C447 WeakPolarHBondContact O-CB 3.5Å; Y443-C447 PolarHBondContact O-N 3.45Å; Y443-C447 PolarHBondContact O-SG 2.73Å; Y443-C447 VanDerWaalsContact O-SG 3.33Å; Y443-R508 PolarHBondContact OH-NH1 2.77Å; Y443-R508 VanDerWaalsContact OH-NH1 3.12Å; Y443-Y514 HydrophobicContact CE2-CE1 4Å; Y443-Y514 PolarHBondContact OH-OH 3.31Å; Y443-Y522 AromaticContact CD1-CD2 3.9Å; Y443-Y522 HydrophobicContact CD1-CD2 3.9Å; Y443-Y522 HydrophobicContact CD1-CE2 4.49Å; Y443-Y522 AromaticContact CD2-CD2 3.93Å; Y443-Y522 HydrophobicContact CD2-CD2 3.93Å; Y443-Y522 AromaticContact CE1-CD2 3.5Å; Y443-Y522 HydrophobicContact CE1-CD2 3.5Å; Y443-Y522 AromaticContact CE1-CE2 3.71Å; Y443-Y522 HydrophobicContact CE1-CE2 3.71Å; Y443-Y522 AromaticContact CE2-CD2 3.56Å; Y443-Y522 HydrophobicContact CE2-CD2 3.56Å; Y443-Y522 HydrophobicContact CE2-CE2 4.17Å; Y443-Y522 HydrophobicContact CG-CD2 4.09Å; Y443-Y522 AromaticContact CZ-CD2 3.33Å; Y443-Y522 AromaticContact CZ-CE2 3.52Å; Y443-Y522 WeakPolarHBondContact OH-CE2 3.33Å; Y443-F525 HydrophobicContact CD1-CB 3.83Å; Y443-F525 AromaticContact CD1-CD1 3.67Å; Y443-F525 HydrophobicContact CD1-CD1 3.67Å; Y443-F525 HydrophobicContact CD1-CD2 4.08Å; Y443-F525 HydrophobicContact CD1-CE1 4.24Å; Y443-F525 AromaticContact CD1-CG 3.57Å; Y443-F525 HydrophobicContact CD1-CG 3.57Å; Y443-F525 AromaticContact CE1-CD1 3.69Å; Y443-F525 HydrophobicContact CE1-CD1 3.69Å; Y443-F525 AromaticContact CE1-CE1 3.85Å; Y443-F525 HydrophobicContact CE1-CE1 3.85Å; Y443-F525 HydrophobicContact CE1-CG 4.05Å; Y443-F525 HydrophobicContact CE1-CZ 4.35Å; Y443-F525 HydrophobicContact CG-CB 4.49Å
444	F	85.5	Confident	83	Confident	103 Å²	103	24.9 Å²	24.9	45%	0.452	12%	0.123	S	C	.	.	H	α-helix	trans	-61.3	-51.8	174.4	176.9	-100	0	0	0	111.3	N442 A446 C447 Q448 E521	N442-F444 VanDerWaalsContact C-N 3.27Å; N442-F444 PolarHBondContact O-N 3.23Å; F444-A446 VanDerWaalsContact C-N 3.3Å; F444-A446 PolarHBondContact O-N 2.85Å; F444-C447 PolarHBondContact O-N 2.98Å; F444-Q448 HydrophobicContact CE1-CG 4.41Å; F444-Q448 HydrophobicContact CZ-CG 4.46Å; F444-Q448 WeakPolarHBondContact O-CG 3.31Å; F444-Q448 PolarHBondContact O-N 3.29Å; F444-Q448 VanDerWaalsContact O-N 3.12Å; F444-E521 HydrophobicContact CB-CG 4.27Å; F444-E521 HydrophobicContact CD2-CG 4.49Å
445	N	86.9	Confident	83	Confident	52 Å²	52	28.1 Å²	28.1	28%	0.278	14%	0.14	S	C	.	.	H	α-helix	trans	-65	-36	176.2	-79.9	-2.7	0	0	0	111.8	F433 N442 Q448 A449	F433-N445 HydrophobicContact CE1-CB 4Å; F433-N445 HydrophobicContact CZ-CB 4.25Å; N442-N445 HydrophobicContact CB-CB 4.44Å; N442-N445 PolarHBondContact ND2-ND2 2.88Å; N442-N445 VanDerWaalsContact ND2-ND2 3.13Å; N442-N445 PolarHBondContact O-N 3.11Å; N442-N445 PolarHBondContact OD1-N 3.11Å; N442-N445 VanDerWaalsContact OD1-N 3.16Å; N445-Q448 PolarHBondContact O-N 2.86Å; N445-A449 WeakPolarHBondContact O-CB 3.5Å; N445-A449 PolarHBondContact O-N 3.3Å
446	A	85.1	Confident	82.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-45.3	175.5	0	0	0	0	0	111.5	F434 V438 N442 Y443 F444 Q448 A449 A450 F525	F434-A446 HydrophobicContact CD2-CB 4.01Å; F434-A446 WeakPolarHBondContact CD2-O 3.24Å; F434-A446 HydrophobicContact CE2-CB 3.75Å; F434-A446 VanDerWaalsContact CE2-O 3.25Å; F434-A446 WeakPolarHBondContact CE2-O 3.32Å; V438-A446 HydrophobicContact CG2-CB 4Å; N442-A446 PolarHBondContact O-N 3.34Å; Y443-A446 PolarHBondContact O-N 3.42Å; F444-A446 VanDerWaalsContact C-N 3.3Å; F444-A446 PolarHBondContact O-N 2.85Å; A446-Q448 PolarHBondContact O-N 3.34Å; A446-A449 PolarHBondContact O-N 3.32Å; A446-A450 WeakPolarHBondContact O-CB 3.39Å; A446-A450 PolarHBondContact O-N 2.56Å; A446-F525 HydrophobicContact CB-CD2 4.15Å
447	C	87.2	Confident	82.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-39.9	176.1	-73	0	0	0	0	112.7	Y443 F444 A449 A450 Q451 R524 F525	Y443-C447 WeakPolarHBondContact O-CB 3.5Å; Y443-C447 PolarHBondContact O-N 3.45Å; Y443-C447 PolarHBondContact O-SG 2.73Å; Y443-C447 VanDerWaalsContact O-SG 3.33Å; F444-C447 PolarHBondContact O-N 2.98Å; C447-A449 VanDerWaalsContact C-N 3.33Å; C447-A450 PolarHBondContact O-N 2.67Å; C447-Q451 WeakPolarHBondContact O-CB 2.8Å; C447-Q451 PolarHBondContact O-N 2.77Å; C447-R524 VanDerWaalsContact SG-C 3.6Å; C447-R524 VanDerWaalsContact SG-CB 3.55Å; C447-F525 PolarHBondContact SG-N 2.66Å
448	Q	89.8	Confident	81.2	Confident	77 Å²	77	33.2 Å²	33.2	36%	0.36	16%	0.163	S	C	.	.	H	α-helix	trans	-64.5	-40.1	175.6	-66.2	-74.2	42.4	0	0	111.6	L421 F444 N445 A446 Q451 R452	L421-Q448 HydrophobicContact CD2-CB 3.63Å; F444-Q448 HydrophobicContact CE1-CG 4.41Å; F444-Q448 HydrophobicContact CZ-CG 4.46Å; F444-Q448 WeakPolarHBondContact O-CG 3.31Å; F444-Q448 PolarHBondContact O-N 3.29Å; F444-Q448 VanDerWaalsContact O-N 3.12Å; N445-Q448 PolarHBondContact O-N 2.86Å; A446-Q448 PolarHBondContact O-N 3.34Å; Q448-Q451 PolarHBondContact O-N 3.21Å; Q448-R452 PolarHBondContact O-N 3.46Å
449	A	87.9	Confident	79.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.4	-39.7	178.5	0	0	0	0	0	111.9	L421 V430 F433 F434 N445 A446 C447 Q451 R452 M453	L421-A449 HydrophobicContact CD1-CB 3.96Å; L421-A449 HydrophobicContact CD2-CB 4.17Å; V430-A449 HydrophobicContact CG1-CB 4.32Å; V430-A449 WeakPolarHBondContact CG1-O 3.33Å; F433-A449 HydrophobicContact CD1-CB 3.62Å; F433-A449 HydrophobicContact CE1-CB 4.12Å; F434-A449 HydrophobicContact CB-CB 3.91Å; F434-A449 HydrophobicContact CD2-CB 4.12Å; N445-A449 WeakPolarHBondContact O-CB 3.5Å; N445-A449 PolarHBondContact O-N 3.3Å; A446-A449 PolarHBondContact O-N 3.32Å; C447-A449 VanDerWaalsContact C-N 3.33Å; A449-Q451 VanDerWaalsContact C-N 3.34Å; A449-Q451 PolarHBondContact O-N 3.32Å; A449-R452 CarbonylContact O-C 3.58Å; A449-R452 PolarHBondContact O-N 3.34Å; A449-R452 VanDerWaalsContact O-N 3.15Å; A449-M453 VanDerWaalsContact O-CG 3.28Å; A449-M453 WeakPolarHBondContact O-CG 3.32Å; A449-M453 PolarHBondContact O-N 3.13Å
450	A	86.8	Confident	78.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-42.6	172.6	0	0	0	0	0	112	F434 A446 C447 R452 M453 F454 W528 F532	F434-A450 HydrophobicContact CD2-CB 4.22Å; F434-A450 HydrophobicContact CE2-CB 3.94Å; A446-A450 WeakPolarHBondContact O-CB 3.39Å; A446-A450 PolarHBondContact O-N 2.56Å; C447-A450 PolarHBondContact O-N 2.67Å; A450-R452 VanDerWaalsContact C-N 3.34Å; A450-R452 PolarHBondContact O-N 2.93Å; A450-M453 WeakPolarHBondContact O-CB 3.44Å; A450-M453 PolarHBondContact O-N 3.05Å; A450-F454 PolarHBondContact O-N 3.43Å; A450-W528 HydrophobicContact CB-CB 3.85Å; A450-W528 HydrophobicContact CB-CD2 3.37Å; A450-W528 HydrophobicContact CB-CE3 3.77Å; A450-W528 HydrophobicContact CB-CG 3.41Å; A450-W528 VanDerWaalsContact CB-CG 3.41Å; A450-W528 HydrophobicContact CB-CZ2 4.48Å; A450-W528 HydrophobicContact CB-CZ3 4.46Å; A450-F532 HydrophobicContact CB-CE2 3.64Å; A450-F532 HydrophobicContact CB-CZ 4.01Å
451	Q	88.4	Confident	76.8	Confident	40 Å²	40	34.1 Å²	34.1	19%	0.187	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-42	173.1	-173.4	175.7	-8.7	0	0	111.9	C447 Q448 A449 F454 I455 W528	C447-Q451 WeakPolarHBondContact O-CB 2.8Å; C447-Q451 PolarHBondContact O-N 2.77Å; Q448-Q451 PolarHBondContact O-N 3.21Å; A449-Q451 VanDerWaalsContact C-N 3.34Å; A449-Q451 PolarHBondContact O-N 3.32Å; Q451-F454 WeakPolarHBondContact O-CB 2.76Å; Q451-F454 PolarHBondContact O-N 3.36Å; Q451-I455 HydrophobicContact CG-CD1 4.11Å; Q451-I455 WeakPolarHBondContact O-CG1 3.48Å; Q451-I455 PolarHBondContact O-N 3.05Å; Q451-W528 VanDerWaalsContact CA-CZ2 3.47Å; Q451-W528 HydrophobicContact CB-CH2 4.15Å; Q451-W528 HydrophobicContact CB-CZ2 3.68Å; Q451-W528 HydrophobicContact CG-CZ2 4.27Å
452	R	86.8	Confident	75	Confident	54 Å²	54	34.4 Å²	34.4	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-40.7	175.8	-174.8	62.1	176.5	177.6	-0.8	111.9	L421 S422 M424 V430 Q448 A449 A450 F454 I455 L456	L421-R452 HydrophobicContact CD1-CB 4.41Å; S422-R452 PolarHBondContact O-NH2 2.92Å; M424-R452 PolarHBondContact O-NE 3.42Å; M424-R452 VanDerWaalsContact O-NE 3.08Å; M424-R452 PolarHBondContact O-NH2 2.86Å; V430-R452 HydrophobicContact CG1-CB 3.76Å; V430-R452 HydrophobicContact CG1-CG 3.79Å; V430-R452 HydrophobicContact CG2-CG 3.92Å; Q448-R452 PolarHBondContact O-N 3.46Å; A449-R452 CarbonylContact O-C 3.58Å; A449-R452 PolarHBondContact O-N 3.34Å; A449-R452 VanDerWaalsContact O-N 3.15Å; A450-R452 VanDerWaalsContact C-N 3.34Å; A450-R452 PolarHBondContact O-N 2.93Å; R452-F454 VanDerWaalsContact C-N 3.28Å; R452-F454 PolarHBondContact O-N 3.38Å; R452-I455 PolarHBondContact O-N 3.09Å; R452-L456 HydrophobicContact CG-CD1 4.29Å; R452-L456 HydrophobicContact CG-CG 4.33Å; R452-L456 WeakPolarHBondContact O-CB 3.06Å; R452-L456 WeakPolarHBondContact O-CG 3.48Å; R452-L456 PolarHBondContact O-N 3.21Å
453	M	83	Confident	73	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.6	-44.6	173.1	-73	167.4	68.4	0	0	110.5	Y427 V430 A431 F434 A449 A450 P458 L494 F532	Y427-M453 HydrophobicContact CD2-CB 4.49Å; Y427-M453 HydrophobicContact CE1-CE 4.09Å; Y427-M453 HydrophobicContact CE2-CB 3.72Å; Y427-M453 HydrophobicContact CE2-CE 4.35Å; Y427-M453 HydrophobicContact CE2-CG 4.06Å; Y427-M453 WeakPolarHBondContact CE2-O 3.45Å; Y427-M453 WeakPolarHBondContact OH-CE 3.39Å; V430-M453 HydrophobicContact CB-CG 4.16Å; V430-M453 HydrophobicContact CG1-CG 3.58Å; A431-M453 HydrophobicContact CB-CE 3.78Å; A431-M453 HydrophobicContact CB-CG 4.48Å; A431-M453 HydrophobicContact CB-SD 4.02Å; F434-M453 HydrophobicContact CB-SD 3.75Å; F434-M453 HydrophobicContact CD1-SD 4.07Å; F434-M453 HydrophobicContact CG-SD 3.85Å; A449-M453 VanDerWaalsContact O-CG 3.28Å; A449-M453 WeakPolarHBondContact O-CG 3.32Å; A449-M453 PolarHBondContact O-N 3.13Å; A450-M453 WeakPolarHBondContact O-CB 3.44Å; A450-M453 PolarHBondContact O-N 3.05Å; M453-P458 VanDerWaalsContact O-CD 3.29Å; M453-P458 WeakPolarHBondContact O-CD 3.28Å; M453-L494 HydrophobicContact CE-CD1 4.06Å; M453-F532 HydrophobicContact CB-CE1 4.43Å; M453-F532 HydrophobicContact CB-CZ 3.96Å; M453-F532 HydrophobicContact CE-CE1 4.33Å; M453-F532 HydrophobicContact CE-CE2 4.24Å; M453-F532 HydrophobicContact CE-CZ 3.98Å; M453-F532 HydrophobicContact SD-CE2 4.41Å; M453-F532 HydrophobicContact SD-CZ 4.22Å
454	F	83.6	Confident	70.6	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-46.6	174.5	165.2	-94.7	0	0	0	112.9	A450 Q451 R452 L456 K457 W461 W528 Y531 L550 Y558 F623	A450-F454 PolarHBondContact O-N 3.43Å; Q451-F454 WeakPolarHBondContact O-CB 2.76Å; Q451-F454 PolarHBondContact O-N 3.36Å; R452-F454 VanDerWaalsContact C-N 3.28Å; R452-F454 PolarHBondContact O-N 3.38Å; F454-L456 PolarHBondContact O-N 3.36Å; F454-K457 PolarHBondContact O-N 3.25Å; F454-K457 VanDerWaalsContact O-N 3.08Å; F454-W461 HydrophobicContact CD2-CZ3 4.14Å; F454-W528 HydrophobicContact CB-CH2 3.86Å; F454-W528 HydrophobicContact CB-CZ3 3.84Å; F454-W528 HydrophobicContact CG-CH2 4.36Å; F454-Y531 HydrophobicContact CD2-CE1 4.08Å; F454-Y531 AromaticContact CD2-CZ 3.99Å; F454-Y531 WeakPolarHBondContact CD2-OH 3.36Å; F454-Y531 WeakPolarHBondContact CE2-OH 3.38Å; F454-L550 HydrophobicContact CB-CD1 4.27Å; F454-L550 HydrophobicContact CD1-CD1 3.52Å; F454-L550 HydrophobicContact CD2-CD1 3.5Å; F454-L550 VanDerWaalsContact CD2-CD1 3.5Å; F454-L550 HydrophobicContact CE1-CD1 3.64Å; F454-L550 HydrophobicContact CE2-CD1 3.61Å; F454-L550 HydrophobicContact CG-CD1 3.46Å; F454-L550 VanDerWaalsContact CG-CD1 3.46Å; F454-L550 HydrophobicContact CZ-CD1 3.69Å; F454-Y558 AromaticContact CE1-CD1 3.86Å; F454-Y558 HydrophobicContact CE1-CD1 3.86Å; F454-Y558 HydrophobicContact CE1-CD2 4.37Å; F454-Y558 AromaticContact CE1-CE1 3.61Å; F454-Y558 HydrophobicContact CE1-CE1 3.61Å; F454-Y558 HydrophobicContact CE1-CE2 4.14Å; F454-Y558 HydrophobicContact CE1-CG 4.24Å; F454-Y558 AromaticContact CE1-CZ 3.76Å; F454-Y558 HydrophobicContact CZ-CD1 4.44Å; F454-Y558 HydrophobicContact CZ-CE1 4.14Å; F454-F623 HydrophobicContact CE2-CB 3.84Å; F454-F623 HydrophobicContact CE2-CD1 4.19Å; F454-F623 HydrophobicContact CE2-CG 4.21Å; F454-F623 HydrophobicContact CZ-CB 3.78Å; F454-F623 AromaticContact CZ-CD1 3.59Å; F454-F623 HydrophobicContact CZ-CD1 3.59Å; F454-F623 HydrophobicContact CZ-CD2 4.38Å; F454-F623 HydrophobicContact CZ-CE1 4.25Å; F454-F623 AromaticContact CZ-CG 3.66Å; F454-F623 HydrophobicContact CZ-CG 3.66Å
455	I	82.9	Confident	68.4	Low	70 Å²	70	32.6 Å²	32.6	36%	0.359	16%	0.164	S	C	.	.	H	α-helix	trans	-64.4	-39.4	-179.4	-70.3	167.3	0	0	0	111.5	Q451 R452 K457 Y558	Q451-I455 HydrophobicContact CG-CD1 4.11Å; Q451-I455 WeakPolarHBondContact O-CG1 3.48Å; Q451-I455 PolarHBondContact O-N 3.05Å; R452-I455 PolarHBondContact O-N 3.09Å; I455-K457 PolarHBondContact O-N 3.06Å; I455-Y558 HydrophobicContact CD1-CE2 4.24Å; I455-Y558 HydrophobicContact CG1-CE2 4.02Å
456	L	76.7	Confident	66.1	Low	41 Å²	41	40.5 Å²	40.5	22%	0.215	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-2.7	176.1	-72	-178.4	0	0	0	113.1	Q425 Y427 V430 R452 F454	Q425-L456 WeakPolarHBondContact O-CD2 3.35Å; Y427-L456 HydrophobicContact CD2-CB 4.36Å; V430-L456 HydrophobicContact CB-CD1 4.26Å; V430-L456 HydrophobicContact CG2-CD1 3.51Å; R452-L456 HydrophobicContact CG-CD1 4.29Å; R452-L456 HydrophobicContact CG-CG 4.33Å; R452-L456 WeakPolarHBondContact O-CB 3.06Å; R452-L456 WeakPolarHBondContact O-CG 3.48Å; R452-L456 PolarHBondContact O-N 3.21Å; F454-L456 PolarHBondContact O-N 3.36Å
457	K	68.1	Low	63.8	Low	88 Å²	88	46.3 Å²	46.3	38%	0.383	22%	0.221	S	C	.	.			trans	49.4	84.6	-177.3	-63.9	-173.4	175.8	-173.6	0	109.5	F454 I455 P459 D605	F454-K457 PolarHBondContact O-N 3.25Å; F454-K457 VanDerWaalsContact O-N 3.08Å; I455-K457 PolarHBondContact O-N 3.06Å; K457-P459 VanDerWaalsContact O-CD 3.24Å; K457-P459 WeakPolarHBondContact O-CD 3.16Å; K457-D605 IonicContact NZ-OD2 3.65Å
458	P	57.7	Low	61.4	Low	3 Å²	3	50.9 Å²	50.9	2%	0.019	24%	0.239	C	C	.	.			trans	-46.6	124.2	179.2	-11.3	15.2	0	0	0	108.7	Y427 M453 A460 W461	Y427-P458 HydrophobicContact CD2-CB 4.11Å; Y427-P458 HydrophobicContact CD2-CG 4.41Å; Y427-P458 HydrophobicContact CE2-CB 3.41Å; Y427-P458 VanDerWaalsContact CE2-CB 3.41Å; Y427-P458 HydrophobicContact CE2-CG 3.49Å; Y427-P458 VanDerWaalsContact CE2-CG 3.49Å; M453-P458 VanDerWaalsContact O-CD 3.29Å; M453-P458 WeakPolarHBondContact O-CD 3.28Å; P458-A460 PolarHBondContact O-N 3.34Å; P458-W461 HydrophobicContact CB-CD2 4.17Å; P458-W461 HydrophobicContact CB-CE3 4.32Å; P458-W461 HydrophobicContact CB-CZ2 4.4Å; P458-W461 HydrophobicContact CB-CZ3 4.5Å; P458-W461 HydrophobicContact CG-CD2 3.68Å; P458-W461 HydrophobicContact CG-CE3 3.43Å; P458-W461 VanDerWaalsContact CG-CE3 3.43Å; P458-W461 HydrophobicContact CG-CH2 3.34Å; P458-W461 HydrophobicContact CG-CZ2 3.58Å; P458-W461 HydrophobicContact CG-CZ3 3.24Å; P458-W461 PolarHBondContact O-N 3.22Å
459	P	49.4	Very low	59.1	Low	33 Å²	33	48.6 Å²	48.6	21%	0.214	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-59.3	-9.3	-174.1	-29	31.1	0	0	0	114.5	K457 W461 V486 T487 L490	K457-P459 VanDerWaalsContact O-CD 3.24Å; K457-P459 WeakPolarHBondContact O-CD 3.16Å; P459-W461 VanDerWaalsContact C-N 3.26Å; P459-W461 PolarHBondContact O-N 3.32Å; P459-V486 HydrophobicContact CB-CG1 3.76Å; P459-V486 HydrophobicContact CG-CG1 4.07Å; P459-T487 WeakPolarHBondContact O-CB 3.39Å; P459-T487 PolarHBondContact O-OG1 3.09Å; P459-L490 HydrophobicContact CB-CD1 3.32Å; P459-L490 HydrophobicContact CG-CD1 3.14Å
460	A	46.8	Very low	56.7	Low	15 Å²	15	54.5 Å²	54.5	12%	0.124	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24.9	169.7	0	0	0	0	0	114.8	P458 T487 F491	P458-A460 PolarHBondContact O-N 3.34Å; A460-T487 VanDerWaalsContact CA-CG2 3.41Å; A460-T487 HydrophobicContact CB-CG2 4.33Å; A460-T487 WeakPolarHBondContact O-CG2 3.38Å; A460-F491 HydrophobicContact CB-CB 4.38Å
461	W	42.1	Very low	54.5	Low	19 Å²	19	61.4 Å²	61.4	7%	0.072	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-95.6	-11.2	-164.8	-59.4	-19.9	0	0	0	115.3	F454 P458 P459 Y531 F532 S535 R607	F454-W461 HydrophobicContact CD2-CZ3 4.14Å; P458-W461 HydrophobicContact CB-CD2 4.17Å; P458-W461 HydrophobicContact CB-CE3 4.32Å; P458-W461 HydrophobicContact CB-CZ2 4.4Å; P458-W461 HydrophobicContact CB-CZ3 4.5Å; P458-W461 HydrophobicContact CG-CD2 3.68Å; P458-W461 HydrophobicContact CG-CE3 3.43Å; P458-W461 VanDerWaalsContact CG-CE3 3.43Å; P458-W461 HydrophobicContact CG-CH2 3.34Å; P458-W461 HydrophobicContact CG-CZ2 3.58Å; P458-W461 HydrophobicContact CG-CZ3 3.24Å; P458-W461 PolarHBondContact O-N 3.22Å; P459-W461 VanDerWaalsContact C-N 3.26Å; P459-W461 PolarHBondContact O-N 3.32Å; W461-Y531 HydrophobicContact CH2-CD1 4.39Å; W461-Y531 AromaticContact CH2-CE1 3.62Å; W461-Y531 HydrophobicContact CH2-CE1 3.62Å; W461-Y531 HydrophobicContact CZ2-CE1 4.41Å; W461-Y531 HydrophobicContact CZ3-CE1 4.17Å; W461-F532 HydrophobicContact CH2-CD1 4.29Å; W461-F532 HydrophobicContact CH2-CE1 4.09Å; W461-F532 HydrophobicContact CZ2-CD1 4.29Å; W461-F532 HydrophobicContact CZ2-CE1 4.49Å; W461-S535 WeakPolarHBondContact CZ2-OG 3.38Å; W461-R607 VanDerWaalsContact CE3-CD 3.49Å
462	F	37	Very low	52.1	Low	55 Å²	55	60.8 Å²	60.8	24%	0.241	28%	0.283	C	S	.	.	S	Bend	trans	-90.3	-14.3	-178.3	-134.3	-79.1	0	0	0	113.6	Y468	F462-Y468 AromaticContact CD1-CD1 3.55Å; F462-Y468 HydrophobicContact CD1-CD1 3.55Å; F462-Y468 AromaticContact CD1-CE1 3.85Å; F462-Y468 HydrophobicContact CD1-CE1 3.85Å; F462-Y468 HydrophobicContact CD1-CG 4.02Å; F462-Y468 AromaticContact CE1-CD1 3.16Å; F462-Y468 HydrophobicContact CE1-CD1 3.16Å; F462-Y468 AromaticContact CE1-CD2 3.68Å; F462-Y468 HydrophobicContact CE1-CD2 3.68Å; F462-Y468 AromaticContact CE1-CE1 3.29Å; F462-Y468 HydrophobicContact CE1-CE1 3.29Å; F462-Y468 AromaticContact CE1-CE2 3.85Å; F462-Y468 HydrophobicContact CE1-CE2 3.85Å; F462-Y468 AromaticContact CE1-CG 3.33Å; F462-Y468 HydrophobicContact CE1-CG 3.33Å; F462-Y468 AromaticContact CE1-CZ 3.66Å; F462-Y468 HydrophobicContact CZ-CD1 4.29Å; F462-Y468 HydrophobicContact CZ-CD2 4.27Å; F462-Y468 HydrophobicContact CZ-CE1 4.11Å; F462-Y468 HydrophobicContact CZ-CE2 4.16Å; F462-Y468 HydrophobicContact CZ-CG 4.33Å
463	A	37.8	Very low	49.9	Very low	22 Å²	22	61 Å²	61	18%	0.182	29%	0.292	C	S	.	.	S	Bend	trans	-93.7	-10	-164.3	0	0	0	0	0	115.9	R484 T487	A463-R484 HydrophobicContact CB-CG 4.49Å; A463-T487 HydrophobicContact CB-CG2 3.48Å; A463-T487 VanDerWaalsContact CB-CG2 3.48Å; A463-T487 WeakPolarHBondContact CB-OG1 3.42Å
464	L	33.7	Very low	47.8	Very low	108 Å²	108	69 Å²	69	57%	0.565	33%	0.329	S	S	*	.	S	Bend	trans	-97.6	-9.6	175	-88.1	161.2	0	0	0	113.6	R466	L464-R466 VanDerWaalsContact C-N 3.3Å; L464-R466 PolarHBondContact O-N 3.27Å
465	S	38.7	Very low	45.8	Very low	5 Å²	5	79.1 Å²	79.1	4%	0.035	37%	0.367	C	S	.	.			trans	-70	95.5	169.4	78.9	0	0	0	0	108.2	N467 Y468 V469 D606 D627	S465-N467 PolarHBondContact O-N 3.27Å; S465-Y468 PolarHBondContact O-N 2.99Å; S465-Y468 VanDerWaalsContact O-N 3.15Å; S465-V469 PolarHBondContact O-N 3.16Å; S465-D606 WeakPolarHBondContact CB-OD2 3.34Å; S465-D606 PolarHBondContact OG-OD2 2.86Å; S465-D627 WeakPolarHBondContact CB-OD2 3.5Å
466	R	37.8	Very low	43.8	Very low	218 Å²	218	77.5 Å²	77.5	82%	0.823	37%	0.365	S	S	*	.	H	α-helix	trans	-39.6	-37	171.9	-92	177.2	160.7	167.1	-4.7	111.4	L464 Q470	L464-R466 VanDerWaalsContact C-N 3.3Å; L464-R466 PolarHBondContact O-N 3.27Å; R466-Q470 WeakPolarHBondContact O-CB 3.43Å; R466-Q470 PolarHBondContact O-N 3.1Å
467	N	37.3	Very low	42.3	Very low	121 Å²	121	82.2 Å²	82.2	65%	0.647	39%	0.39	S	S	*	.	H	α-helix	trans	-72.7	-39.7	-173.9	-64	-18.2	0	0	0	114.4	S465 Q470 Y471	S465-N467 PolarHBondContact O-N 3.27Å; N467-Q470 PolarHBondContact O-N 3.16Å; N467-Y471 WeakPolarHBondContact O-CB 3.47Å; N467-Y471 PolarHBondContact O-N 3.33Å
468	Y	37.8	Very low	41	Very low	98 Å²	98	83.6 Å²	83.6	38%	0.384	40%	0.402	S	S	.	.	H	α-helix	trans	-78.8	-35.2	-178.6	-162.8	-103.9	0	0	0	112.7	F462 S465 Q470 Y471 I472	F462-Y468 AromaticContact CD1-CD1 3.55Å; F462-Y468 HydrophobicContact CD1-CD1 3.55Å; F462-Y468 AromaticContact CD1-CE1 3.85Å; F462-Y468 HydrophobicContact CD1-CE1 3.85Å; F462-Y468 HydrophobicContact CD1-CG 4.02Å; F462-Y468 AromaticContact CE1-CD1 3.16Å; F462-Y468 HydrophobicContact CE1-CD1 3.16Å; F462-Y468 AromaticContact CE1-CD2 3.68Å; F462-Y468 HydrophobicContact CE1-CD2 3.68Å; F462-Y468 AromaticContact CE1-CE1 3.29Å; F462-Y468 HydrophobicContact CE1-CE1 3.29Å; F462-Y468 AromaticContact CE1-CE2 3.85Å; F462-Y468 HydrophobicContact CE1-CE2 3.85Å; F462-Y468 AromaticContact CE1-CG 3.33Å; F462-Y468 HydrophobicContact CE1-CG 3.33Å; F462-Y468 AromaticContact CE1-CZ 3.66Å; F462-Y468 HydrophobicContact CZ-CD1 4.29Å; F462-Y468 HydrophobicContact CZ-CD2 4.27Å; F462-Y468 HydrophobicContact CZ-CE1 4.11Å; F462-Y468 HydrophobicContact CZ-CE2 4.16Å; F462-Y468 HydrophobicContact CZ-CG 4.33Å; S465-Y468 PolarHBondContact O-N 2.99Å; S465-Y468 VanDerWaalsContact O-N 3.15Å; Y468-Q470 VanDerWaalsContact C-N 3.27Å; Y468-Q470 PolarHBondContact O-N 3.43Å; Y468-Y471 PolarHBondContact O-N 3.19Å; Y468-I472 HydrophobicContact CD1-CD1 3.65Å; Y468-I472 HydrophobicContact CD1-CG1 4.09Å; Y468-I472 HydrophobicContact CE1-CD1 3.14Å; Y468-I472 HydrophobicContact CE1-CG1 3.93Å; Y468-I472 PolarHBondContact O-N 3.37Å
469	V	39.9	Very low	40.1	Very low	29 Å²	29	86.2 Å²	86.2	18%	0.176	42%	0.417	C	S	.	.	H	α-helix	trans	-61.8	-40.2	168.9	177.3	0	0	0	0	109.4	S465 C473 A480	S465-V469 PolarHBondContact O-N 3.16Å; V469-C473 WeakPolarHBondContact O-CA 3.28Å; V469-C473 WeakPolarHBondContact O-CB 3.35Å; V469-C473 PolarHBondContact O-N 3.42Å; V469-C473 PolarHBondContact O-SG 2.82Å; V469-A480 HydrophobicContact CG1-CB 4.45Å
470	Q	39	Very low	39.5	Very low	124 Å²	124	85.1 Å²	85.1	58%	0.579	41%	0.411	S	S	*	.	H	α-helix	trans	-67.5	-39.5	177.3	-161	168.7	2.8	0	0	112.8	R466 N467 Y468 C473 Q474	R466-Q470 WeakPolarHBondContact O-CB 3.43Å; R466-Q470 PolarHBondContact O-N 3.1Å; N467-Q470 PolarHBondContact O-N 3.16Å; Y468-Q470 VanDerWaalsContact C-N 3.27Å; Y468-Q470 PolarHBondContact O-N 3.43Å; Q470-C473 PolarHBondContact O-N 3.18Å; Q470-Q474 PolarHBondContact O-N 3.25Å
471	Y	39.9	Very low	39.2	Very low	144 Å²	144	85.1 Å²	85.1	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-66.3	-44.4	176.2	-173.3	-98	0	0	0	112.8	N467 Y468 Q474	N467-Y471 WeakPolarHBondContact O-CB 3.47Å; N467-Y471 PolarHBondContact O-N 3.33Å; Y468-Y471 PolarHBondContact O-N 3.19Å; Y471-Q474 PolarHBondContact O-N 2.8Å
472	I	37.3	Very low	38.9	Very low	27 Å²	27	87.9 Å²	87.9	14%	0.138	43%	0.426	C	S	.	.	H	α-helix	trans	-73.1	-36.5	174.9	-67.6	-171	0	0	0	111.4	Y468 Q474 R475 A476 V479 A480	Y468-I472 HydrophobicContact CD1-CD1 3.65Å; Y468-I472 HydrophobicContact CD1-CG1 4.09Å; Y468-I472 HydrophobicContact CE1-CD1 3.14Å; Y468-I472 HydrophobicContact CE1-CG1 3.93Å; Y468-I472 PolarHBondContact O-N 3.37Å; I472-Q474 PolarHBondContact O-N 2.86Å; I472-R475 PolarHBondContact O-N 3.5Å; I472-A476 HydrophobicContact CG2-CB 4.46Å; I472-A476 PolarHBondContact O-N 3.42Å; I472-V479 HydrophobicContact CD1-CG1 4.48Å; I472-V479 HydrophobicContact CG2-CB 3.92Å; I472-V479 HydrophobicContact CG2-CG1 4.22Å; I472-A480 HydrophobicContact CG2-CB 4.25Å
473	C	40.3	Very low	38.9	Very low	59 Å²	59	89.3 Å²	89.3	40%	0.399	43%	0.432	S	S	.	.	H	α-helix	trans	-62.9	-26.1	175.7	-79.1	0	0	0	0	112.4	V469 Q470	V469-C473 WeakPolarHBondContact O-CA 3.28Å; V469-C473 WeakPolarHBondContact O-CB 3.35Å; V469-C473 PolarHBondContact O-N 3.42Å; V469-C473 PolarHBondContact O-SG 2.82Å; Q470-C473 PolarHBondContact O-N 3.18Å
474	Q	39.7	Very low	38.9	Very low	168 Å²	168	94.6 Å²	94.6	79%	0.785	45%	0.447	S	S	*	.	H	α-helix	trans	-74.3	-24.7	171.7	-94.9	-176.7	-10.2	0	0	113.8	Q470 Y471 I472	Q470-Q474 PolarHBondContact O-N 3.25Å; Y471-Q474 PolarHBondContact O-N 2.8Å; I472-Q474 PolarHBondContact O-N 2.86Å
475	R	41.1	Very low	39.1	Very low	214 Å²	214	90.3 Å²	90.3	81%	0.808	43%	0.426	S	S	*	.	H	α-helix	trans	-118.9	-20.7	-168.7	-121.2	176.9	166	113.1	-3	116	I472	I472-R475 PolarHBondContact O-N 3.5Å
476	A	42.2	Very low	39.1	Very low	37 Å²	37	92.5 Å²	92.5	31%	0.306	44%	0.439	S	S	.	.			trans	-149.3	99.7	-179.7	0	0	0	0	0	112.2	I472 N478 V479	I472-A476 HydrophobicContact CG2-CB 4.46Å; I472-A476 PolarHBondContact O-N 3.42Å; A476-N478 PolarHBondContact O-N 3.41Å; A476-V479 HydrophobicContact CB-CB 4.41Å; A476-V479 HydrophobicContact CB-CG2 4Å; A476-V479 PolarHBondContact O-N 3.29Å
477	N	45.5	Very low	39.2	Very low	139 Å²	139	82.9 Å²	82.9	74%	0.743	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-14.2	179.2	-78.6	-21.3	0	0	0	115.2
478	N	39.9	Very low	39.4	Very low	118 Å²	118	81.7 Å²	81.7	63%	0.631	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-9.8	-171.6	-71.5	-15.4	0	0	0	116	A476	A476-N478 PolarHBondContact O-N 3.41Å
479	V	38.2	Very low	39.5	Very low	57 Å²	57	80.2 Å²	80.2	35%	0.345	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-38.6	-172.2	178.9	0	0	0	0	112.3	I472 A476 A481 M482 F483	I472-V479 HydrophobicContact CD1-CG1 4.48Å; I472-V479 HydrophobicContact CG2-CB 3.92Å; I472-V479 HydrophobicContact CG2-CG1 4.22Å; A476-V479 HydrophobicContact CB-CB 4.41Å; A476-V479 HydrophobicContact CB-CG2 4Å; A476-V479 PolarHBondContact O-N 3.29Å; V479-A481 VanDerWaalsContact C-N 3.34Å; V479-A481 PolarHBondContact O-N 3.45Å; V479-M482 PolarHBondContact O-N 2.9Å; V479-F483 HydrophobicContact CG1-CD2 3.87Å; V479-F483 HydrophobicContact CG1-CE2 3.57Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å
480	A	37.8	Very low	39.9	Very low	11 Å²	11	79 Å²	79	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-28.4	-173	0	0	0	0	0	115.1	V469 I472	V469-A480 HydrophobicContact CG1-CB 4.45Å; I472-A480 HydrophobicContact CG2-CB 4.25Å
481	A	40.7	Very low	40.3	Very low	14 Å²	14	76.1 Å²	76.1	12%	0.116	37%	0.367	C	S	.	.	H	α-helix	trans	-75.9	-36.7	179.8	0	0	0	0	0	112.5	P222 V479 F483 R484 T485	P222-A481 HydrophobicContact CB-CB 4.26Å; V479-A481 VanDerWaalsContact C-N 3.34Å; V479-A481 PolarHBondContact O-N 3.45Å; A481-F483 VanDerWaalsContact C-N 3.29Å; A481-F483 PolarHBondContact O-N 2.9Å; A481-R484 PolarHBondContact O-N 2.92Å; A481-T485 PolarHBondContact O-N 2.85Å; A481-T485 PolarHBondContact O-OG1 2.87Å; A481-T485 VanDerWaalsContact O-OG1 3.12Å
482	M	35.9	Very low	40.8	Very low	78 Å²	78	73.8 Å²	73.8	38%	0.384	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-43.4	174	-175.8	-161.5	-61.9	0	0	110.8	L270 V479 T485 V486	L270-M482 HydrophobicContact CD2-CE 4.16Å; V479-M482 PolarHBondContact O-N 2.9Å; M482-T485 PolarHBondContact O-N 3.16Å; M482-V486 HydrophobicContact CG-CG2 4.4Å; M482-V486 VanDerWaalsContact O-CG2 3.29Å; M482-V486 WeakPolarHBondContact O-CG2 3.33Å; M482-V486 PolarHBondContact O-N 3.45Å; M482-V486 VanDerWaalsContact O-N 3.16Å
483	F	36.8	Very low	41.6	Very low	85 Å²	85	74.6 Å²	74.6	37%	0.373	36%	0.359	S	S	.	.	H	α-helix	trans	-58.7	-54.6	178.9	-84.7	-81.2	0	0	0	111.1	V479 A481 T485 V486 T487	V479-F483 HydrophobicContact CG1-CD2 3.87Å; V479-F483 HydrophobicContact CG1-CE2 3.57Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å; A481-F483 VanDerWaalsContact C-N 3.29Å; A481-F483 PolarHBondContact O-N 2.9Å; F483-T485 VanDerWaalsContact C-N 3.27Å; F483-T485 PolarHBondContact O-N 3.04Å; F483-T485 VanDerWaalsContact O-N 3.13Å; F483-V486 PolarHBondContact O-N 3.43Å; F483-T487 VanDerWaalsContact O-CB 3.3Å; F483-T487 WeakPolarHBondContact O-CB 3.39Å; F483-T487 PolarHBondContact O-N 3.17Å; F483-T487 PolarHBondContact O-OG1 3.36Å
484	R	36.5	Very low	42.5	Very low	132 Å²	132	71.9 Å²	71.9	50%	0.498	34%	0.341	S	S	.	.	H	α-helix	trans	-55.3	-35.7	-177.8	-69.9	-172.8	-133.6	-162.2	1.4	114.7	A463 A481 T487 E488	A463-R484 HydrophobicContact CB-CG 4.49Å; A481-R484 PolarHBondContact O-N 2.92Å; R484-T487 VanDerWaalsContact O-CB 3.3Å; R484-T487 WeakPolarHBondContact O-CB 3.3Å; R484-E488 PolarHBondContact O-N 3.46Å; R484-E488 VanDerWaalsContact O-N 3.13Å
485	T	38.3	Very low	43.5	Very low	18 Å²	18	70.1 Å²	70.1	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-81.7	-38.4	-177.4	-37.2	0	0	0	0	112.8	L273 R274 D275 A481 M482 F483 T487 E488 R489	L273-T485 WeakPolarHBondContact O-CB 3.36Å; L273-T485 WeakPolarHBondContact O-CG2 3.24Å; L273-T485 PolarHBondContact O-OG1 2.87Å; L273-T485 VanDerWaalsContact O-OG1 3.06Å; R274-T485 VanDerWaalsContact CA-CG2 3.43Å; R274-T485 WeakPolarHBondContact CA-OG1 3.22Å; D275-T485 HydrophobicContact CB-CG2 3.99Å; D275-T485 VanDerWaalsContact N-CG2 3.32Å; A481-T485 PolarHBondContact O-N 2.85Å; A481-T485 PolarHBondContact O-OG1 2.87Å; A481-T485 VanDerWaalsContact O-OG1 3.12Å; M482-T485 PolarHBondContact O-N 3.16Å; F483-T485 VanDerWaalsContact C-N 3.27Å; F483-T485 PolarHBondContact O-N 3.04Å; F483-T485 VanDerWaalsContact O-N 3.13Å; T485-T487 VanDerWaalsContact C-N 3.26Å; T485-T487 PolarHBondContact O-N 3.18Å; T485-E488 PolarHBondContact O-N 3.49Å; T485-R489 PolarHBondContact O-N 3.2Å
486	V	38.4	Very low	44.5	Very low	51 Å²	51	61.8 Å²	61.8	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-61.5	-41.7	171.1	175.6	0	0	0	0	109.1	P459 M482 F483 R489 L490	P459-V486 HydrophobicContact CB-CG1 3.76Å; P459-V486 HydrophobicContact CG-CG1 4.07Å; M482-V486 HydrophobicContact CG-CG2 4.4Å; M482-V486 VanDerWaalsContact O-CG2 3.29Å; M482-V486 WeakPolarHBondContact O-CG2 3.33Å; M482-V486 PolarHBondContact O-N 3.45Å; M482-V486 VanDerWaalsContact O-N 3.16Å; F483-V486 PolarHBondContact O-N 3.43Å; V486-R489 PolarHBondContact O-N 3.09Å; V486-L490 HydrophobicContact CG1-CD1 3.69Å; V486-L490 WeakPolarHBondContact O-CB 3.37Å; V486-L490 VanDerWaalsContact O-CD1 3.27Å; V486-L490 WeakPolarHBondContact O-CD1 3.43Å; V486-L490 WeakPolarHBondContact O-CG 3.48Å; V486-L490 PolarHBondContact O-N 2.86Å; V486-L490 VanDerWaalsContact O-N 3.13Å
487	T	39.7	Very low	45.6	Very low	16 Å²	16	60.1 Å²	60.1	10%	0.098	29%	0.291	C	S	.	.	H	α-helix	trans	-52.4	-54.1	172.1	-60.1	0	0	0	0	113.2	P459 A460 A463 F483 R484 T485 L490 F491	P459-T487 WeakPolarHBondContact O-CB 3.39Å; P459-T487 PolarHBondContact O-OG1 3.09Å; A460-T487 VanDerWaalsContact CA-CG2 3.41Å; A460-T487 HydrophobicContact CB-CG2 4.33Å; A460-T487 WeakPolarHBondContact O-CG2 3.38Å; A463-T487 HydrophobicContact CB-CG2 3.48Å; A463-T487 VanDerWaalsContact CB-CG2 3.48Å; A463-T487 WeakPolarHBondContact CB-OG1 3.42Å; F483-T487 VanDerWaalsContact O-CB 3.3Å; F483-T487 WeakPolarHBondContact O-CB 3.39Å; F483-T487 PolarHBondContact O-N 3.17Å; F483-T487 PolarHBondContact O-OG1 3.36Å; R484-T487 VanDerWaalsContact O-CB 3.3Å; R484-T487 WeakPolarHBondContact O-CB 3.3Å; T485-T487 VanDerWaalsContact C-N 3.26Å; T485-T487 PolarHBondContact O-N 3.18Å; T487-L490 PolarHBondContact O-N 2.6Å; T487-F491 WeakPolarHBondContact O-CB 3.29Å; T487-F491 PolarHBondContact O-N 3.47Å
488	E	42	Very low	46.6	Very low	96 Å²	96	54.6 Å²	54.6	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-38	-177.9	-83.8	172.3	142.4	0	0	113.5	D275 R484 T485 L490 F491 R492	D275-E488 WeakPolarHBondContact CB-OE2 3.32Å; R484-E488 PolarHBondContact O-N 3.46Å; R484-E488 VanDerWaalsContact O-N 3.13Å; T485-E488 PolarHBondContact O-N 3.49Å; E488-L490 VanDerWaalsContact C-N 3.32Å; E488-L490 PolarHBondContact O-N 3.09Å; E488-F491 WeakPolarHBondContact O-CB 3.35Å; E488-F491 PolarHBondContact O-N 3.45Å; E488-R492 PolarHBondContact O-N 2.92Å
489	R	40.8	Very low	47.9	Very low	68 Å²	68	50.7 Å²	50.7	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-40.8	178.3	-156.5	-176.3	-176.7	163.4	4.4	111	T259 L260 W428 T485 V486 R492 F493	T259-R489 HydrophobicContact CG2-CG 4.32Å; L260-R489 PolarHBondContact O-NH1 3.33Å; L260-R489 PolarHBondContact O-NH2 3.47Å; L260-R489 VanDerWaalsContact O-NH2 3.08Å; W428-R489 HydrophobicContact CH2-CB 4.42Å; W428-R489 HydrophobicContact CH2-CG 3.94Å; W428-R489 HydrophobicContact CZ2-CB 4.4Å; W428-R489 HydrophobicContact CZ2-CG 4.17Å; T485-R489 PolarHBondContact O-N 3.2Å; V486-R489 PolarHBondContact O-N 3.09Å; R489-R492 PolarHBondContact O-N 3.24Å; R489-F493 PolarHBondContact O-N 2.78Å
490	L	46.7	Very low	49.3	Very low	4 Å²	4	48.3 Å²	48.3	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-71.7	-36.3	176.2	-79	155.7	0	0	0	112.8	Y427 W428 P459 V486 T487 E488 R492 F493 L494	Y427-L490 HydrophobicContact CD1-CD2 3.22Å; Y427-L490 HydrophobicContact CE1-CD2 3.8Å; Y427-L490 HydrophobicContact CG-CD2 3.89Å; W428-L490 HydrophobicContact CD2-CD2 4.17Å; W428-L490 HydrophobicContact CH2-CD2 4.14Å; W428-L490 HydrophobicContact CH2-CG 4.23Å; W428-L490 HydrophobicContact CZ2-CD2 3.59Å; W428-L490 HydrophobicContact CZ2-CG 3.59Å; P459-L490 HydrophobicContact CB-CD1 3.32Å; P459-L490 HydrophobicContact CG-CD1 3.14Å; V486-L490 HydrophobicContact CG1-CD1 3.69Å; V486-L490 WeakPolarHBondContact O-CB 3.37Å; V486-L490 VanDerWaalsContact O-CD1 3.27Å; V486-L490 WeakPolarHBondContact O-CD1 3.43Å; V486-L490 WeakPolarHBondContact O-CG 3.48Å; V486-L490 PolarHBondContact O-N 2.86Å; V486-L490 VanDerWaalsContact O-N 3.13Å; T487-L490 PolarHBondContact O-N 2.6Å; E488-L490 VanDerWaalsContact C-N 3.32Å; E488-L490 PolarHBondContact O-N 3.09Å; L490-R492 VanDerWaalsContact C-N 3.31Å; L490-R492 PolarHBondContact O-N 3.12Å; L490-F493 PolarHBondContact O-N 3.16Å; L490-L494 VanDerWaalsContact O-CB 3.3Å; L490-L494 WeakPolarHBondContact O-CB 3.39Å; L490-L494 PolarHBondContact O-N 3.24Å
491	F	48.5	Very low	50.7	Low	63 Å²	63	47.9 Å²	47.9	28%	0.276	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-44.2	172	-177.3	-96.8	0	0	0	111.4	A460 T487 E488 K495	A460-F491 HydrophobicContact CB-CB 4.38Å; T487-F491 WeakPolarHBondContact O-CB 3.29Å; T487-F491 PolarHBondContact O-N 3.47Å; E488-F491 WeakPolarHBondContact O-CB 3.35Å; E488-F491 PolarHBondContact O-N 3.45Å; F491-K495 VanDerWaalsContact O-CB 3.3Å; F491-K495 WeakPolarHBondContact O-CB 3.36Å; F491-K495 PolarHBondContact O-N 2.83Å
492	R	50.4	Low	52	Low	94 Å²	94	49 Å²	49	36%	0.355	24%	0.243	S	C	.	.	H	α-helix	trans	-70.1	-37.7	175.8	-75	-173.7	-172.4	174.6	2.9	114	Q277 E488 R489 L490 K495 S496	Q277-R492 VanDerWaalsContact CD-NH1 3.32Å; Q277-R492 VanDerWaalsContact OE1-CZ 3.26Å; E488-R492 PolarHBondContact O-N 2.92Å; R489-R492 PolarHBondContact O-N 3.24Å; L490-R492 VanDerWaalsContact C-N 3.31Å; L490-R492 PolarHBondContact O-N 3.12Å; R492-K495 PolarHBondContact O-N 3.4Å; R492-S496 WeakPolarHBondContact O-CB 3.22Å; R492-S496 PolarHBondContact O-N 3.36Å
493	F	54.1	Low	53.4	Low	44 Å²	44	46.1 Å²	46.1	19%	0.193	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-51.3	174.8	-173.1	-102.9	0	0	0	109.9	W428 A431 R489 L490 K495 S496 T497	W428-F493 HydrophobicContact CE3-CB 4.06Å; W428-F493 AromaticContact CE3-CD1 3.81Å; W428-F493 HydrophobicContact CE3-CD1 3.81Å; W428-F493 AromaticContact CE3-CD2 3.69Å; W428-F493 HydrophobicContact CE3-CD2 3.69Å; W428-F493 HydrophobicContact CE3-CE1 4.15Å; W428-F493 HydrophobicContact CE3-CE2 4Å; W428-F493 AromaticContact CE3-CG 3.55Å; W428-F493 HydrophobicContact CE3-CG 3.55Å; W428-F493 HydrophobicContact CE3-CZ 4.22Å; W428-F493 HydrophobicContact CH2-CB 3.57Å; W428-F493 HydrophobicContact CH2-CD2 4.41Å; W428-F493 HydrophobicContact CH2-CG 4.03Å; W428-F493 HydrophobicContact CZ3-CB 3.18Å; W428-F493 AromaticContact CZ3-CD1 3.83Å; W428-F493 HydrophobicContact CZ3-CD1 3.83Å; W428-F493 AromaticContact CZ3-CD2 3.28Å; W428-F493 HydrophobicContact CZ3-CD2 3.28Å; W428-F493 HydrophobicContact CZ3-CE2 4.03Å; W428-F493 AromaticContact CZ3-CG 3.11Å; W428-F493 HydrophobicContact CZ3-CG 3.11Å; A431-F493 HydrophobicContact CB-CD1 4.14Å; A431-F493 HydrophobicContact CB-CE1 3.49Å; A431-F493 VanDerWaalsContact CB-CE1 3.49Å; R489-F493 PolarHBondContact O-N 2.78Å; L490-F493 PolarHBondContact O-N 3.16Å; F493-K495 VanDerWaalsContact C-N 3.29Å; F493-K495 PolarHBondContact O-N 3.38Å; F493-S496 CarbonylContact O-C 3.5Å; F493-S496 WeakPolarHBondContact O-CA 3.49Å; F493-S496 WeakPolarHBondContact O-CB 3.47Å; F493-S496 PolarHBondContact O-N 3.19Å; F493-T497 WeakPolarHBondContact CE1-OG1 3.37Å; F493-T497 WeakPolarHBondContact O-CB 3.34Å; F493-T497 PolarHBondContact O-N 3.08Å; F493-T497 PolarHBondContact O-OG1 3.44Å
494	L	59.5	Low	54.7	Low	3 Å²	3	42.2 Å²	42.2	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-55.9	-43.8	175	-174.6	63.7	0	0	0	111.5	M453 L490 S496 T497 I498 F532	M453-L494 HydrophobicContact CE-CD1 4.06Å; L490-L494 VanDerWaalsContact O-CB 3.3Å; L490-L494 WeakPolarHBondContact O-CB 3.39Å; L490-L494 PolarHBondContact O-N 3.24Å; L494-S496 VanDerWaalsContact C-N 3.34Å; L494-S496 PolarHBondContact O-N 3.23Å; L494-T497 WeakPolarHBondContact O-CB 3.28Å; L494-T497 PolarHBondContact O-N 3.04Å; L494-I498 HydrophobicContact CD1-CD1 4.02Å; L494-I498 HydrophobicContact CD1-CG1 4.18Å; L494-I498 HydrophobicContact CD2-CD1 4.36Å; L494-I498 HydrophobicContact CG-CD1 3.7Å; L494-I498 HydrophobicContact CG-CG1 4.3Å; L494-I498 VanDerWaalsContact O-CB 3.3Å; L494-I498 WeakPolarHBondContact O-CB 3.25Å; L494-I498 WeakPolarHBondContact O-CD1 3.38Å; L494-I498 WeakPolarHBondContact O-CG1 3.15Å; L494-I498 PolarHBondContact O-N 3.33Å; L494-F532 HydrophobicContact CD1-CB 4.24Å; L494-F532 HydrophobicContact CD1-CD1 4.23Å; L494-F532 HydrophobicContact CD1-CG 4.21Å; L494-F532 HydrophobicContact CD2-CD1 4.44Å
495	K	60.8	Low	56	Low	131 Å²	131	39.1 Å²	39.1	57%	0.57	20%	0.204	S	C	*	.	H	α-helix	trans	-62.5	-37.9	174.8	-170.2	173.4	-176.8	171.1	0	112.7	F491 R492 F493 G499	F491-K495 VanDerWaalsContact O-CB 3.3Å; F491-K495 WeakPolarHBondContact O-CB 3.36Å; F491-K495 PolarHBondContact O-N 2.83Å; R492-K495 PolarHBondContact O-N 3.4Å; F493-K495 VanDerWaalsContact C-N 3.29Å; F493-K495 PolarHBondContact O-N 3.38Å; K495-G499 PolarHBondContact O-N 3.16Å
496	S	62.1	Low	57.4	Low	39 Å²	39	45 Å²	45	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-70.2	-42.2	174.8	-173.6	0	0	0	0	111.7	R492 F493 L494 G499 N500	R492-S496 WeakPolarHBondContact O-CB 3.22Å; R492-S496 PolarHBondContact O-N 3.36Å; F493-S496 CarbonylContact O-C 3.5Å; F493-S496 WeakPolarHBondContact O-CA 3.49Å; F493-S496 WeakPolarHBondContact O-CB 3.47Å; F493-S496 PolarHBondContact O-N 3.19Å; L494-S496 VanDerWaalsContact C-N 3.34Å; L494-S496 PolarHBondContact O-N 3.23Å; S496-G499 PolarHBondContact O-N 3.33Å; S496-N500 WeakPolarHBondContact O-CB 3.28Å; S496-N500 PolarHBondContact O-N 2.97Å
497	T	64.4	Low	58.4	Low	1 Å²	1	47 Å²	47	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-53.4	175.4	-60.1	0	0	0	0	110.1	F434 E435 F493 L494 G499 N500 I501	F434-T497 HydrophobicContact CD1-CG2 4.19Å; E435-T497 HydrophobicContact CG-CG2 3.4Å; E435-T497 WeakPolarHBondContact OE1-CA 3.35Å; E435-T497 WeakPolarHBondContact OE1-CB 3.37Å; E435-T497 VanDerWaalsContact OE1-CG2 3.29Å; E435-T497 WeakPolarHBondContact OE1-CG2 3.39Å; E435-T497 PolarHBondContact OE1-OG1 3.12Å; F493-T497 WeakPolarHBondContact CE1-OG1 3.37Å; F493-T497 WeakPolarHBondContact O-CB 3.34Å; F493-T497 PolarHBondContact O-N 3.08Å; F493-T497 PolarHBondContact O-OG1 3.44Å; L494-T497 WeakPolarHBondContact O-CB 3.28Å; L494-T497 PolarHBondContact O-N 3.04Å; T497-G499 VanDerWaalsContact C-N 3.31Å; T497-G499 PolarHBondContact O-N 3.35Å; T497-N500 PolarHBondContact O-N 3.27Å; T497-I501 HydrophobicContact CG2-CD1 3.79Å; T497-I501 WeakPolarHBondContact O-CB 3.4Å; T497-I501 WeakPolarHBondContact O-CG1 3.48Å; T497-I501 PolarHBondContact O-N 3.33Å
498	I	66.9	Low	59.7	Low	24 Å²	24	48.5 Å²	48.5	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-42.3	175.2	-67.5	166.6	0	0	0	110.4	L494 I501 G502 F532 V533 T536	L494-I498 HydrophobicContact CD1-CD1 4.02Å; L494-I498 HydrophobicContact CD1-CG1 4.18Å; L494-I498 HydrophobicContact CD2-CD1 4.36Å; L494-I498 HydrophobicContact CG-CD1 3.7Å; L494-I498 HydrophobicContact CG-CG1 4.3Å; L494-I498 VanDerWaalsContact O-CB 3.3Å; L494-I498 WeakPolarHBondContact O-CB 3.25Å; L494-I498 WeakPolarHBondContact O-CD1 3.38Å; L494-I498 WeakPolarHBondContact O-CG1 3.15Å; L494-I498 PolarHBondContact O-N 3.33Å; I498-I501 PolarHBondContact O-N 3.34Å; I498-G502 PolarHBondContact O-N 3.32Å; I498-F532 HydrophobicContact CD1-CB 3.85Å; I498-F532 VanDerWaalsContact CD1-O 3.28Å; I498-F532 WeakPolarHBondContact CD1-O 3.16Å; I498-F532 HydrophobicContact CG1-CB 4.27Å; I498-V533 HydrophobicContact CG2-CG2 3.63Å; I498-T536 HydrophobicContact CD1-CG2 3.65Å
499	G	66.5	Low	60.4	Low	35 Å²	35	51.7 Å²	51.7	36%	0.361	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-44.8	176.3	0	0	0	0	0	112.8	K495 S496 T497 L503	K495-G499 PolarHBondContact O-N 3.16Å; S496-G499 PolarHBondContact O-N 3.33Å; T497-G499 VanDerWaalsContact C-N 3.31Å; T497-G499 PolarHBondContact O-N 3.35Å; G499-L503 WeakPolarHBondContact O-CB 3.16Å; G499-L503 VanDerWaalsContact O-CG 3.29Å; G499-L503 WeakPolarHBondContact O-CG 3.3Å; G499-L503 PolarHBondContact O-N 3.02Å
500	N	67.7	Low	61.1	Low	7 Å²	7	51.9 Å²	51.9	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-44.8	173.5	-73.2	-15.4	0	0	0	110.6	K350 T389 E435 S496 T497 L503 I504	K350-N500 PolarHBondContact NZ-OD1 2.78Å; T389-N500 HydrophobicContact CG2-CB 3.93Å; E435-N500 PolarHBondContact OE2-ND2 2.94Å; S496-N500 WeakPolarHBondContact O-CB 3.28Å; S496-N500 PolarHBondContact O-N 2.97Å; T497-N500 PolarHBondContact O-N 3.27Å; N500-L503 WeakPolarHBondContact O-CB 3.48Å; N500-L503 PolarHBondContact O-N 3.06Å; N500-I504 WeakPolarHBondContact O-CD1 3.47Å; N500-I504 VanDerWaalsContact O-CG1 3.24Å; N500-I504 WeakPolarHBondContact O-CG1 3.45Å; N500-I504 PolarHBondContact O-N 3.1Å
501	I	68.4	Low	61.6	Low	2 Å²	2	54.6 Å²	54.6	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-44.9	-179.4	-67.9	166.6	0	0	0	111.8	F434 V438 T497 I498 L503 I504 E505 F525 M529	F434-I501 HydrophobicContact CD1-CD1 3.94Å; F434-I501 HydrophobicContact CE1-CD1 3.29Å; F434-I501 HydrophobicContact CZ-CD1 4.1Å; V438-I501 HydrophobicContact CB-CG1 4.49Å; V438-I501 HydrophobicContact CG1-CG1 4.15Å; V438-I501 HydrophobicContact CG1-CG2 4.14Å; V438-I501 HydrophobicContact CG2-CD1 4.25Å; T497-I501 HydrophobicContact CG2-CD1 3.79Å; T497-I501 WeakPolarHBondContact O-CB 3.4Å; T497-I501 WeakPolarHBondContact O-CG1 3.48Å; T497-I501 PolarHBondContact O-N 3.33Å; I498-I501 PolarHBondContact O-N 3.34Å; I501-L503 PolarHBondContact O-N 3.06Å; I501-I504 CarbonylContact O-C 3.48Å; I501-I504 WeakPolarHBondContact O-CA 3.42Å; I501-I504 WeakPolarHBondContact O-CB 3.34Å; I501-I504 PolarHBondContact O-N 2.92Å; I501-E505 PolarHBondContact O-N 3.35Å; I501-F525 HydrophobicContact CG2-CZ 3.83Å; I501-M529 HydrophobicContact CB-SD 4.45Å; I501-M529 HydrophobicContact CD1-SD 4.24Å; I501-M529 HydrophobicContact CG2-SD 3.62Å
502	G	67.1	Low	61.9	Low	38 Å²	38	59.7 Å²	59.7	39%	0.392	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-33.5	176	0	0	0	0	0	112.2	I498 K506	I498-G502 PolarHBondContact O-N 3.32Å; G502-K506 PolarHBondContact O-N 2.87Å; G502-K506 VanDerWaalsContact O-N 3.08Å
503	L	64.9	Low	62.4	Low	18 Å²	18	61.5 Å²	61.5	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-46.2	169.9	-75	170.1	0	0	0	112.1	F358 I393 G499 N500 I501 E505 K506 F507	F358-L503 HydrophobicContact CD1-CD2 3.82Å; F358-L503 HydrophobicContact CD2-CD2 4.32Å; F358-L503 HydrophobicContact CE1-CD1 4.03Å; F358-L503 HydrophobicContact CE1-CD2 3.44Å; F358-L503 VanDerWaalsContact CE1-CD2 3.44Å; F358-L503 HydrophobicContact CE1-CG 4.3Å; F358-L503 HydrophobicContact CE2-CD2 3.97Å; F358-L503 HydrophobicContact CG-CD2 4.25Å; F358-L503 HydrophobicContact CZ-CD2 3.53Å; F358-L503 HydrophobicContact CZ-CG 4.42Å; I393-L503 HydrophobicContact CD1-CB 3.87Å; I393-L503 HydrophobicContact CD1-CD1 3.93Å; I393-L503 HydrophobicContact CD1-CG 4.34Å; I393-L503 HydrophobicContact CG1-CB 4.26Å; G499-L503 WeakPolarHBondContact O-CB 3.16Å; G499-L503 VanDerWaalsContact O-CG 3.29Å; G499-L503 WeakPolarHBondContact O-CG 3.3Å; G499-L503 PolarHBondContact O-N 3.02Å; N500-L503 WeakPolarHBondContact O-CB 3.48Å; N500-L503 PolarHBondContact O-N 3.06Å; I501-L503 PolarHBondContact O-N 3.06Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 3.27Å; L503-K506 PolarHBondContact O-N 3.26Å; L503-F507 WeakPolarHBondContact O-CD2 3.3Å; L503-F507 PolarHBondContact O-N 2.8Å
504	I	64.4	Low	62.9	Low	3 Å²	3	61.1 Å²	61.1	2%	0.015	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-44.1	175.9	-70.1	159.4	0	0	0	110.6	T389 V392 L439 N500 I501 F507 R508	T389-I504 HydrophobicContact CG2-CD1 4.34Å; T389-I504 HydrophobicContact CG2-CG1 4.28Å; V392-I504 HydrophobicContact CG1-CG1 4.28Å; V392-I504 HydrophobicContact CG1-CG2 4.21Å; L439-I504 HydrophobicContact CD2-CD1 3.46Å; L439-I504 VanDerWaalsContact CD2-CD1 3.46Å; L439-I504 HydrophobicContact CD2-CG1 4.19Å; L439-I504 HydrophobicContact CG-CD1 3.99Å; N500-I504 WeakPolarHBondContact O-CD1 3.47Å; N500-I504 VanDerWaalsContact O-CG1 3.24Å; N500-I504 WeakPolarHBondContact O-CG1 3.45Å; N500-I504 PolarHBondContact O-N 3.1Å; I501-I504 CarbonylContact O-C 3.48Å; I501-I504 WeakPolarHBondContact O-CA 3.42Å; I501-I504 WeakPolarHBondContact O-CB 3.34Å; I501-I504 PolarHBondContact O-N 2.92Å; I504-F507 PolarHBondContact O-N 3.24Å; I504-R508 HydrophobicContact CG2-CG 4.23Å; I504-R508 VanDerWaalsContact CG2-NE 3.34Å; I504-R508 WeakPolarHBondContact O-CB 3.5Å; I504-R508 VanDerWaalsContact O-CG 3.3Å; I504-R508 WeakPolarHBondContact O-CG 3.27Å; I504-R508 PolarHBondContact O-N 3.36Å; I504-R508 VanDerWaalsContact O-N 3.16Å
505	E	65.3	Low	63.2	Low	67 Å²	67	63.9 Å²	63.9	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-43	177	-75.6	-164	151.3	0	0	112.6	I501 L503 F507 R508 F525	I501-E505 PolarHBondContact O-N 3.35Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 3.27Å; E505-F507 PolarHBondContact O-N 3.43Å; E505-R508 PolarHBondContact O-N 2.86Å; E505-F525 WeakPolarHBondContact OE1-CE1 3.38Å
506	K	65.9	Low	63.5	Low	141 Å²	141	66.5 Å²	66.5	61%	0.613	33%	0.331	S	S	*	.	H	α-helix	trans	-59.3	-30.2	-179.8	-172.1	178.7	177.8	-175.4	0	113.2	G502 L503	G502-K506 PolarHBondContact O-N 2.87Å; G502-K506 VanDerWaalsContact O-N 3.08Å; L503-K506 PolarHBondContact O-N 3.26Å
507	F	59.4	Low	63.7	Low	94 Å²	94	71.9 Å²	71.9	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-105.1	1.9	-177.4	-70.5	-83.2	0	0	0	114	I393 L503 I504 E505	I393-F507 HydrophobicContact CB-CD2 4.45Å; I393-F507 HydrophobicContact CG1-CD2 4.2Å; I393-F507 HydrophobicContact CG2-CD2 4.16Å; I393-F507 HydrophobicContact CG2-CE2 3.88Å; I393-F507 HydrophobicContact CG2-CZ 4.19Å; L503-F507 WeakPolarHBondContact O-CD2 3.3Å; L503-F507 PolarHBondContact O-N 2.8Å; I504-F507 PolarHBondContact O-N 3.24Å; E505-F507 PolarHBondContact O-N 3.43Å
508	R	67.2	Low	64	Low	46 Å²	46	75.3 Å²	75.3	17%	0.174	37%	0.37	C	S	.	.	S	Bend	trans	-89.9	163.5	177.8	-89.3	-174.5	178.2	169.5	7.4	113.8	V438 L439 E441 Y443 I504 E505	V438-R508 PolarHBondContact O-NH1 3.37Å; V438-R508 PolarHBondContact O-NH2 3.15Å; L439-R508 VanDerWaalsContact C-NH2 3.31Å; L439-R508 PolarHBondContact O-NH2 3.46Å; E441-R508 VanDerWaalsContact CG-CZ 3.44Å; E441-R508 IonicContact OE1-CZ 3.24Å; E441-R508 IonicContact OE1-NE 2.77Å; E441-R508 PolarHBondContact OE1-NE 3.43Å; Y443-R508 PolarHBondContact OH-NH1 2.77Å; Y443-R508 VanDerWaalsContact OH-NH1 3.12Å; I504-R508 HydrophobicContact CG2-CG 4.23Å; I504-R508 VanDerWaalsContact CG2-NE 3.34Å; I504-R508 WeakPolarHBondContact O-CB 3.5Å; I504-R508 VanDerWaalsContact O-CG 3.3Å; I504-R508 WeakPolarHBondContact O-CG 3.27Å; I504-R508 PolarHBondContact O-N 3.36Å; I504-R508 VanDerWaalsContact O-N 3.16Å; E505-R508 PolarHBondContact O-N 2.86Å
509	R	56.8	Low	64.3	Low	163 Å²	163	76.8 Å²	76.8	62%	0.615	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-76.2	158.3	-175.5	-63.7	-175.9	-178.6	174.9	1.1	113.1	Q513	R509-Q513 VanDerWaalsContact CD-OE1 3.22Å
510	S	55.7	Low	64.7	Low	72 Å²	72	78.1 Å²	78.1	50%	0.503	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-55.2	139.4	179.8	175.1	0	0	0	0	113.7	Q512 Q513	S510-Q512 PolarHBondContact O-N 2.87Å; S510-Q513 PolarHBondContact O-N 3.44Å
511	L	56.8	Low	65.3	Low	61 Å²	61	79.4 Å²	79.4	32%	0.319	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-52.7	-23.1	-179.4	-143.1	138.2	0	0	0	114.4	Q513 Y522	L511-Q513 PolarHBondContact O-N 2.78Å; L511-Y522 HydrophobicContact CD1-CD1 3.52Å; L511-Y522 HydrophobicContact CD1-CE1 3.22Å; L511-Y522 HydrophobicContact CD2-CD1 4.4Å; L511-Y522 HydrophobicContact CG-CD1 3.9Å; L511-Y522 HydrophobicContact CG-CE1 3.95Å
512	Q	54.9	Low	65.8	Low	171 Å²	171	80.8 Å²	80.8	80%	0.799	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-67.1	-13.1	-178.3	-67.8	179.3	-11.3	0	0	114.3	S510	S510-Q512 PolarHBondContact O-N 2.87Å
513	Q	61.1	Low	66.5	Low	132 Å²	132	84.2 Å²	84.2	62%	0.617	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-89.6	-9.3	-176.5	-65.1	-177.2	-7	0	0	114.6	R509 S510 L511	R509-Q513 VanDerWaalsContact CD-OE1 3.22Å; S510-Q513 PolarHBondContact O-N 3.44Å; L511-Q513 PolarHBondContact O-N 2.78Å
514	Y	64.2	Low	67.3	Low	36 Å²	36	86.3 Å²	86.3	14%	0.141	39%	0.393	C	S	.	.	S	Bend	trans	-82.4	149.5	-177.9	-68	-76	0	0	0	112.7	Y443 N518 Q519	Y443-Y514 HydrophobicContact CE2-CE1 4Å; Y443-Y514 PolarHBondContact OH-OH 3.31Å; Y514-N518 HydrophobicContact CD1-CB 4.19Å; Y514-N518 HydrophobicContact CG-CB 4.49Å; Y514-Q519 PolarHBondContact O-NE2 2.93Å
515	S	65.6	Low	68.2	Low	61 Å²	61	86.2 Å²	86.2	43%	0.427	39%	0.392	S	S	.	.			trans	-57.3	153.4	167.3	70.2	0	0	0	0	110.5	E517 N518 Q519	S515-E517 PolarHBondContact O-N 3.43Å; S515-N518 PolarHBondContact O-N 3.3Å; S515-N518 WeakPolarHBondContact OG-CB 3.48Å; S515-N518 PolarHBondContact OG-N 2.86Å; S515-N518 PolarHBondContact OG-ND2 2.83Å; S515-Q519 WeakPolarHBondContact O-CG 3.47Å; S515-Q519 PolarHBondContact O-N 3.08Å
516	R	68.1	Low	69.1	Low	185 Å²	185	85.7 Å²	85.7	70%	0.698	39%	0.391	S	S	*	.	H	α-helix	trans	-56.2	-36.7	-177.4	-167.8	-179.8	-179.7	178.3	0.9	112.7	M520	R516-M520 HydrophobicContact CG-CE 4.35Å; R516-M520 WeakPolarHBondContact O-CG 3.45Å; R516-M520 PolarHBondContact O-N 2.72Å
517	E	66.1	Low	70.1	Confident	153 Å²	153	79 Å²	79	72%	0.715	36%	0.362	S	S	*	.	H	α-helix	trans	-67.9	-46.8	175.3	-68.3	174	-179.7	0	0	111.6	S515 Q519 M520 E521	S515-E517 PolarHBondContact O-N 3.43Å; E517-Q519 VanDerWaalsContact C-N 3.26Å; E517-Q519 PolarHBondContact O-N 2.84Å; E517-M520 WeakPolarHBondContact O-CB 3.24Å; E517-M520 PolarHBondContact O-N 2.97Å; E517-E521 PolarHBondContact O-N 2.8Å; E517-E521 VanDerWaalsContact O-N 3.15Å
518	N	71	Confident	71.5	Confident	73 Å²	73	74.7 Å²	74.7	39%	0.39	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-31.8	176.1	-76.8	-10.4	0	0	0	112.2	Y514 S515 M520 E521 Y522	Y514-N518 HydrophobicContact CD1-CB 4.19Å; Y514-N518 HydrophobicContact CG-CB 4.49Å; S515-N518 PolarHBondContact O-N 3.3Å; S515-N518 WeakPolarHBondContact OG-CB 3.48Å; S515-N518 PolarHBondContact OG-N 2.86Å; S515-N518 PolarHBondContact OG-ND2 2.83Å; N518-M520 VanDerWaalsContact C-N 3.3Å; N518-M520 PolarHBondContact O-N 3.37Å; N518-E521 PolarHBondContact O-N 3.27Å; N518-Y522 WeakPolarHBondContact O-CB 3.32Å; N518-Y522 PolarHBondContact O-N 2.93Å
519	Q	72.8	Confident	72.1	Confident	55 Å²	55	73.1 Å²	73.1	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-35.5	172.7	-69.4	176.2	19	0	0	112.2	Y514 S515 E517 R523	Y514-Q519 PolarHBondContact O-NE2 2.93Å; S515-Q519 WeakPolarHBondContact O-CG 3.47Å; S515-Q519 PolarHBondContact O-N 3.08Å; E517-Q519 VanDerWaalsContact C-N 3.26Å; E517-Q519 PolarHBondContact O-N 2.84Å; Q519-R523 WeakPolarHBondContact O-CG 3.27Å; Q519-R523 PolarHBondContact O-N 3.47Å; Q519-R523 VanDerWaalsContact O-N 3.13Å
520	M	75.9	Confident	73.3	Confident	62 Å²	62	68.6 Å²	68.6	31%	0.305	33%	0.326	S	S	.	.	H	α-helix	trans	-69	-48	177.1	-65.3	-178.5	-174.8	0	0	111	R516 E517 N518 Y522 R523 R524 Y579	R516-M520 HydrophobicContact CG-CE 4.35Å; R516-M520 WeakPolarHBondContact O-CG 3.45Å; R516-M520 PolarHBondContact O-N 2.72Å; E517-M520 WeakPolarHBondContact O-CB 3.24Å; E517-M520 PolarHBondContact O-N 2.97Å; N518-M520 VanDerWaalsContact C-N 3.3Å; N518-M520 PolarHBondContact O-N 3.37Å; M520-Y522 VanDerWaalsContact C-N 3.32Å; M520-Y522 PolarHBondContact O-N 3.47Å; M520-R523 PolarHBondContact O-N 3.31Å; M520-R524 PolarHBondContact O-N 3Å; M520-R524 VanDerWaalsContact O-N 3.08Å; M520-Y579 WeakPolarHBondContact CE-O 3.29Å
521	E	80.6	Confident	74.8	Confident	35 Å²	35	65.2 Å²	65.2	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-37.4	177	-66.4	-56.2	138.9	0	0	111.7	F444 E517 N518 R523 R524 F525	F444-E521 HydrophobicContact CB-CG 4.27Å; F444-E521 HydrophobicContact CD2-CG 4.49Å; E517-E521 PolarHBondContact O-N 2.8Å; E517-E521 VanDerWaalsContact O-N 3.15Å; N518-E521 PolarHBondContact O-N 3.27Å; E521-R523 VanDerWaalsContact C-N 3.32Å; E521-R523 PolarHBondContact O-N 3.17Å; E521-R524 PolarHBondContact O-N 3.45Å; E521-R524 IonicContact OE1-NH1 2.9Å; E521-R524 PolarHBondContact OE1-NH1 3.03Å; E521-R524 IonicContact OE2-CZ 2.79Å; E521-R524 IonicContact OE2-NH1 2.57Å; E521-R524 PolarHBondContact OE2-NH1 3.33Å; E521-F525 WeakPolarHBondContact O-CB 3.43Å; E521-F525 PolarHBondContact O-N 3.47Å
522	Y	79	Confident	76	Confident	30 Å²	30	62.3 Å²	62.3	12%	0.118	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-42.6	173	-172.9	-95.9	0	0	0	112.2	Y443 L511 N518 M520 F525 L526	Y443-Y522 AromaticContact CD1-CD2 3.9Å; Y443-Y522 HydrophobicContact CD1-CD2 3.9Å; Y443-Y522 HydrophobicContact CD1-CE2 4.49Å; Y443-Y522 AromaticContact CD2-CD2 3.93Å; Y443-Y522 HydrophobicContact CD2-CD2 3.93Å; Y443-Y522 AromaticContact CE1-CD2 3.5Å; Y443-Y522 HydrophobicContact CE1-CD2 3.5Å; Y443-Y522 AromaticContact CE1-CE2 3.71Å; Y443-Y522 HydrophobicContact CE1-CE2 3.71Å; Y443-Y522 AromaticContact CE2-CD2 3.56Å; Y443-Y522 HydrophobicContact CE2-CD2 3.56Å; Y443-Y522 HydrophobicContact CE2-CE2 4.17Å; Y443-Y522 HydrophobicContact CG-CD2 4.09Å; Y443-Y522 AromaticContact CZ-CD2 3.33Å; Y443-Y522 AromaticContact CZ-CE2 3.52Å; Y443-Y522 WeakPolarHBondContact OH-CE2 3.33Å; L511-Y522 HydrophobicContact CD1-CD1 3.52Å; L511-Y522 HydrophobicContact CD1-CE1 3.22Å; L511-Y522 HydrophobicContact CD2-CD1 4.4Å; L511-Y522 HydrophobicContact CG-CD1 3.9Å; L511-Y522 HydrophobicContact CG-CE1 3.95Å; N518-Y522 WeakPolarHBondContact O-CB 3.32Å; N518-Y522 PolarHBondContact O-N 2.93Å; M520-Y522 VanDerWaalsContact C-N 3.32Å; M520-Y522 PolarHBondContact O-N 3.47Å; Y522-F525 HydrophobicContact CD2-CD1 4.34Å; Y522-F525 HydrophobicContact CE2-CD1 4.27Å; Y522-F525 HydrophobicContact CE2-CE1 4.47Å; Y522-F525 WeakPolarHBondContact O-CB 3.13Å; Y522-F525 PolarHBondContact O-N 3.13Å; Y522-L526 HydrophobicContact CD1-CD1 4.03Å; Y522-L526 HydrophobicContact CD1-CG 4.06Å; Y522-L526 HydrophobicContact CE1-CD1 3.71Å; Y522-L526 HydrophobicContact CE1-CD2 3.85Å; Y522-L526 HydrophobicContact CE1-CG 3.73Å; Y522-L526 WeakPolarHBondContact O-CG 3.48Å; Y522-L526 PolarHBondContact O-N 3.42Å
523	R	80.1	Confident	76.9	Confident	110 Å²	110	56.4 Å²	56.4	42%	0.415	26%	0.263	S	S	.	.	H	α-helix	trans	-68.8	-35.4	177.2	-71.7	178.7	-178.6	-169.6	-3.5	112.9	Q519 M520 E521 F525 L526 F527 Y579	Q519-R523 WeakPolarHBondContact O-CG 3.27Å; Q519-R523 PolarHBondContact O-N 3.47Å; Q519-R523 VanDerWaalsContact O-N 3.13Å; M520-R523 PolarHBondContact O-N 3.31Å; E521-R523 VanDerWaalsContact C-N 3.32Å; E521-R523 PolarHBondContact O-N 3.17Å; R523-F525 VanDerWaalsContact C-N 3.28Å; R523-L526 PolarHBondContact O-N 2.65Å; R523-F527 PolarHBondContact O-N 3.16Å; R523-F527 VanDerWaalsContact O-N 3.15Å; R523-Y579 HydrophobicContact CB-CD2 4.19Å; R523-Y579 HydrophobicContact CB-CE2 3.35Å; R523-Y579 HydrophobicContact CG-CE2 4.19Å
524	R	83.2	Confident	77.8	Confident	63 Å²	63	51.4 Å²	51.4	24%	0.238	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-38.5	170.3	-68.6	175.8	69.4	-162	2.5	111	C447 M520 E521 F527 W528	C447-R524 VanDerWaalsContact SG-C 3.6Å; C447-R524 VanDerWaalsContact SG-CB 3.55Å; M520-R524 PolarHBondContact O-N 3Å; M520-R524 VanDerWaalsContact O-N 3.08Å; E521-R524 PolarHBondContact O-N 3.45Å; E521-R524 IonicContact OE1-NH1 2.9Å; E521-R524 PolarHBondContact OE1-NH1 3.03Å; E521-R524 IonicContact OE2-CZ 2.79Å; E521-R524 IonicContact OE2-NH1 2.57Å; E521-R524 PolarHBondContact OE2-NH1 3.33Å; R524-F527 WeakPolarHBondContact O-CB 3.43Å; R524-F527 PolarHBondContact O-N 3.13Å; R524-W528 VanDerWaalsContact O-CD1 3.22Å; R524-W528 PolarHBondContact O-N 3.13Å
525	F	82.9	Confident	78.2	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-42.9	174.2	163.5	-97.7	0	0	0	111.9	F434 V438 Y443 A446 C447 I501 E505 E521 Y522 R523 F527 W528 M529	F434-F525 HydrophobicContact CE2-CD2 4.25Å; F434-F525 HydrophobicContact CE2-CE2 4.17Å; F434-F525 HydrophobicContact CZ-CD2 4.16Å; F434-F525 AromaticContact CZ-CE2 3.71Å; F434-F525 HydrophobicContact CZ-CE2 3.71Å; V438-F525 HydrophobicContact CG1-CE2 4.36Å; V438-F525 HydrophobicContact CG1-CZ 4.07Å; V438-F525 HydrophobicContact CG2-CD2 4.23Å; V438-F525 HydrophobicContact CG2-CE2 3.38Å; V438-F525 HydrophobicContact CG2-CZ 3.94Å; Y443-F525 HydrophobicContact CD1-CB 3.83Å; Y443-F525 AromaticContact CD1-CD1 3.67Å; Y443-F525 HydrophobicContact CD1-CD1 3.67Å; Y443-F525 HydrophobicContact CD1-CD2 4.08Å; Y443-F525 HydrophobicContact CD1-CE1 4.24Å; Y443-F525 AromaticContact CD1-CG 3.57Å; Y443-F525 HydrophobicContact CD1-CG 3.57Å; Y443-F525 AromaticContact CE1-CD1 3.69Å; Y443-F525 HydrophobicContact CE1-CD1 3.69Å; Y443-F525 AromaticContact CE1-CE1 3.85Å; Y443-F525 HydrophobicContact CE1-CE1 3.85Å; Y443-F525 HydrophobicContact CE1-CG 4.05Å; Y443-F525 HydrophobicContact CE1-CZ 4.35Å; Y443-F525 HydrophobicContact CG-CB 4.49Å; A446-F525 HydrophobicContact CB-CD2 4.15Å; C447-F525 PolarHBondContact SG-N 2.66Å; I501-F525 HydrophobicContact CG2-CZ 3.83Å; E505-F525 WeakPolarHBondContact OE1-CE1 3.38Å; E521-F525 WeakPolarHBondContact O-CB 3.43Å; E521-F525 PolarHBondContact O-N 3.47Å; Y522-F525 HydrophobicContact CD2-CD1 4.34Å; Y522-F525 HydrophobicContact CE2-CD1 4.27Å; Y522-F525 HydrophobicContact CE2-CE1 4.47Å; Y522-F525 WeakPolarHBondContact O-CB 3.13Å; Y522-F525 PolarHBondContact O-N 3.13Å; R523-F525 VanDerWaalsContact C-N 3.28Å; F525-F527 VanDerWaalsContact C-N 3.3Å; F525-F527 PolarHBondContact O-N 3.42Å; F525-W528 WeakPolarHBondContact O-CA 3.48Å; F525-W528 WeakPolarHBondContact O-CB 3.46Å; F525-W528 PolarHBondContact O-N 3.43Å; F525-M529 HydrophobicContact CD1-CG 4.32Å; F525-M529 HydrophobicContact CD2-CE 4.42Å; F525-M529 HydrophobicContact CD2-CG 4.43Å; F525-M529 HydrophobicContact CE1-CG 3.8Å; F525-M529 HydrophobicContact CE2-CE 3.88Å; F525-M529 HydrophobicContact CE2-CG 3.91Å; F525-M529 HydrophobicContact CE2-SD 3.83Å; F525-M529 HydrophobicContact CZ-CE 4.38Å; F525-M529 HydrophobicContact CZ-CG 3.57Å; F525-M529 HydrophobicContact CZ-SD 3.72Å; F525-M529 WeakPolarHBondContact O-CG 3.34Å; F525-M529 PolarHBondContact O-N 2.6Å
526	L	83.1	Confident	78.3	Confident	55 Å²	55	48.8 Å²	48.8	29%	0.288	23%	0.225	S	C	.	.	H	α-helix	trans	-58.6	-40.5	174.2	-70.5	-180	0	0	0	112.5	Y522 R523 W528 M529 D530	Y522-L526 HydrophobicContact CD1-CD1 4.03Å; Y522-L526 HydrophobicContact CD1-CG 4.06Å; Y522-L526 HydrophobicContact CE1-CD1 3.71Å; Y522-L526 HydrophobicContact CE1-CD2 3.85Å; Y522-L526 HydrophobicContact CE1-CG 3.73Å; Y522-L526 WeakPolarHBondContact O-CG 3.48Å; Y522-L526 PolarHBondContact O-N 3.42Å; R523-L526 PolarHBondContact O-N 2.65Å; L526-W528 VanDerWaalsContact C-N 3.31Å; L526-W528 PolarHBondContact O-N 3.49Å; L526-M529 WeakPolarHBondContact O-CB 3.41Å; L526-M529 PolarHBondContact O-N 2.87Å; L526-M529 VanDerWaalsContact O-N 3.14Å; L526-D530 PolarHBondContact O-N 3.24Å
527	F	88.6	Confident	78.3	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-45.1	172.4	162.9	-89.7	0	0	0	111.7	R523 R524 F525 M529 D530 Y531 P548 V549 L550 P560 S561 Y562 V577	R523-F527 PolarHBondContact O-N 3.16Å; R523-F527 VanDerWaalsContact O-N 3.15Å; R524-F527 WeakPolarHBondContact O-CB 3.43Å; R524-F527 PolarHBondContact O-N 3.13Å; F525-F527 VanDerWaalsContact C-N 3.3Å; F525-F527 PolarHBondContact O-N 3.42Å; F527-M529 VanDerWaalsContact C-N 3.26Å; F527-M529 PolarHBondContact O-N 3.47Å; F527-D530 PolarHBondContact O-N 3.34Å; F527-Y531 HydrophobicContact CZ-CD2 4.06Å; F527-Y531 WeakPolarHBondContact O-CB 3.48Å; F527-Y531 PolarHBondContact O-N 3.44Å; F527-P548 HydrophobicContact CD2-CB 4.26Å; F527-P548 HydrophobicContact CE2-CB 3.76Å; F527-P548 HydrophobicContact CZ-CB 4.49Å; F527-V549 WeakPolarHBondContact CZ-O 3.41Å; F527-L550 HydrophobicContact CE1-CD2 3.62Å; F527-L550 HydrophobicContact CE1-CG 4.42Å; F527-L550 HydrophobicContact CZ-CD2 3.86Å; F527-L550 HydrophobicContact CZ-CG 4.33Å; F527-P560 HydrophobicContact CB-CB 4.48Å; F527-P560 HydrophobicContact CD1-CB 3.46Å; F527-P560 VanDerWaalsContact CD1-CB 3.46Å; F527-P560 HydrophobicContact CD1-CG 3.89Å; F527-P560 HydrophobicContact CD2-CB 4.16Å; F527-P560 HydrophobicContact CE1-CB 3.64Å; F527-P560 HydrophobicContact CE1-CG 3.98Å; F527-P560 HydrophobicContact CE2-CB 4.32Å; F527-P560 HydrophobicContact CG-CB 3.74Å; F527-P560 HydrophobicContact CZ-CB 4.07Å; F527-S561 WeakPolarHBondContact CE2-O 3.43Å; F527-Y562 HydrophobicContact CD2-CD2 4.49Å; F527-Y562 AromaticContact CD2-CE2 3.91Å; F527-Y562 HydrophobicContact CD2-CE2 3.91Å; F527-Y562 AromaticContact CD2-CZ 3.92Å; F527-V577 HydrophobicContact CB-CG2 4.43Å; F527-V577 HydrophobicContact CD2-CG2 4.13Å; F527-V577 HydrophobicContact CG-CG2 4.44Å
528	W	87.1	Confident	78.1	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-33.5	177.1	-77.3	114.7	0	0	0	112.1	A450 Q451 F454 R524 F525 L526 Y531 F532 L550	A450-W528 HydrophobicContact CB-CB 3.85Å; A450-W528 HydrophobicContact CB-CD2 3.37Å; A450-W528 HydrophobicContact CB-CE3 3.77Å; A450-W528 HydrophobicContact CB-CG 3.41Å; A450-W528 VanDerWaalsContact CB-CG 3.41Å; A450-W528 HydrophobicContact CB-CZ2 4.48Å; A450-W528 HydrophobicContact CB-CZ3 4.46Å; Q451-W528 VanDerWaalsContact CA-CZ2 3.47Å; Q451-W528 HydrophobicContact CB-CH2 4.15Å; Q451-W528 HydrophobicContact CB-CZ2 3.68Å; Q451-W528 HydrophobicContact CG-CZ2 4.27Å; F454-W528 HydrophobicContact CB-CH2 3.86Å; F454-W528 HydrophobicContact CB-CZ3 3.84Å; F454-W528 HydrophobicContact CG-CH2 4.36Å; R524-W528 VanDerWaalsContact O-CD1 3.22Å; R524-W528 PolarHBondContact O-N 3.13Å; F525-W528 WeakPolarHBondContact O-CA 3.48Å; F525-W528 WeakPolarHBondContact O-CB 3.46Å; F525-W528 PolarHBondContact O-N 3.43Å; L526-W528 VanDerWaalsContact C-N 3.31Å; L526-W528 PolarHBondContact O-N 3.49Å; W528-Y531 HydrophobicContact CE3-CD1 4.16Å; W528-Y531 HydrophobicContact CE3-CG 4.48Å; W528-Y531 HydrophobicContact CZ3-CD1 4.09Å; W528-Y531 HydrophobicContact CZ3-CE1 4.35Å; W528-Y531 PolarHBondContact O-N 3.16Å; W528-F532 HydrophobicContact CB-CE2 4.36Å; W528-F532 HydrophobicContact CE3-CE2 4.1Å; W528-F532 AromaticContact CE3-CZ 4Å; W528-F532 HydrophobicContact CE3-CZ 4Å; W528-F532 HydrophobicContact CZ3-CZ 4.36Å; W528-F532 WeakPolarHBondContact O-CB 3.42Å; W528-F532 WeakPolarHBondContact O-CD2 3.39Å; W528-F532 WeakPolarHBondContact O-CG 3.31Å; W528-F532 PolarHBondContact O-N 3.46Å; W528-L550 HydrophobicContact CH2-CD1 3.56Å; W528-L550 HydrophobicContact CH2-CD2 3.8Å; W528-L550 HydrophobicContact CH2-CG 4.23Å; W528-L550 HydrophobicContact CZ2-CD1 4.5Å; W528-L550 HydrophobicContact CZ2-CD2 4.01Å; W528-L550 HydrophobicContact CZ3-CD1 4Å; W528-L550 HydrophobicContact CZ3-CD2 4.41Å
529	M	81.1	Confident	77.6	Confident	13 Å²	13	40.5 Å²	40.5	6%	0.064	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-50.8	171.9	-66.6	-55.5	85.8	0	0	111.7	F434 I501 F525 L526 F527 Y531 F532 V533	F434-M529 HydrophobicContact CE1-CE 3.64Å; F434-M529 HydrophobicContact CE2-CE 4.36Å; F434-M529 HydrophobicContact CZ-CE 3.23Å; F434-M529 HydrophobicContact CZ-SD 4.39Å; I501-M529 HydrophobicContact CB-SD 4.45Å; I501-M529 HydrophobicContact CD1-SD 4.24Å; I501-M529 HydrophobicContact CG2-SD 3.62Å; F525-M529 HydrophobicContact CD1-CG 4.32Å; F525-M529 HydrophobicContact CD2-CE 4.42Å; F525-M529 HydrophobicContact CD2-CG 4.43Å; F525-M529 HydrophobicContact CE1-CG 3.8Å; F525-M529 HydrophobicContact CE2-CE 3.88Å; F525-M529 HydrophobicContact CE2-CG 3.91Å; F525-M529 HydrophobicContact CE2-SD 3.83Å; F525-M529 HydrophobicContact CZ-CE 4.38Å; F525-M529 HydrophobicContact CZ-CG 3.57Å; F525-M529 HydrophobicContact CZ-SD 3.72Å; F525-M529 WeakPolarHBondContact O-CG 3.34Å; F525-M529 PolarHBondContact O-N 2.6Å; L526-M529 WeakPolarHBondContact O-CB 3.41Å; L526-M529 PolarHBondContact O-N 2.87Å; L526-M529 VanDerWaalsContact O-N 3.14Å; F527-M529 VanDerWaalsContact C-N 3.26Å; F527-M529 PolarHBondContact O-N 3.47Å; M529-Y531 VanDerWaalsContact C-N 3.29Å; M529-Y531 PolarHBondContact O-N 2.77Å; M529-F532 HydrophobicContact CE-CD2 3.84Å; M529-F532 PolarHBondContact O-N 3.42Å; M529-V533 VanDerWaalsContact O-CB 3.24Å; M529-V533 WeakPolarHBondContact O-CB 3.02Å; M529-V533 WeakPolarHBondContact O-CG2 3.4Å; M529-V533 PolarHBondContact O-N 3.12Å
530	D	82.1	Confident	77.2	Confident	68 Å²	68	44 Å²	44	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-55.5	-47.7	173.8	-70.2	-9.3	0	0	0	110.6	L526 F527 F532 V533 E534 P548 Y562	L526-D530 PolarHBondContact O-N 3.24Å; F527-D530 PolarHBondContact O-N 3.34Å; D530-F532 PolarHBondContact O-N 3.41Å; D530-V533 PolarHBondContact O-N 3.03Å; D530-E534 WeakPolarHBondContact O-CB 3.49Å; D530-E534 VanDerWaalsContact O-CG 3.29Å; D530-E534 WeakPolarHBondContact O-CG 3.49Å; D530-E534 PolarHBondContact O-N 3.39Å; D530-P548 HydrophobicContact CB-CB 4.35Å; D530-P548 HydrophobicContact CB-CG 4.38Å; D530-Y562 PolarHBondContact OD2-OH 3.49Å
531	Y	86.6	Confident	76.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-45.9	-179.6	-170.4	-91.7	0	0	0	112.7	F454 W461 F527 W528 M529 S535 P548 L550 F624 P625	F454-Y531 HydrophobicContact CD2-CE1 4.08Å; F454-Y531 AromaticContact CD2-CZ 3.99Å; F454-Y531 WeakPolarHBondContact CD2-OH 3.36Å; F454-Y531 WeakPolarHBondContact CE2-OH 3.38Å; W461-Y531 HydrophobicContact CH2-CD1 4.39Å; W461-Y531 AromaticContact CH2-CE1 3.62Å; W461-Y531 HydrophobicContact CH2-CE1 3.62Å; W461-Y531 HydrophobicContact CZ2-CE1 4.41Å; W461-Y531 HydrophobicContact CZ3-CE1 4.17Å; F527-Y531 HydrophobicContact CZ-CD2 4.06Å; F527-Y531 WeakPolarHBondContact O-CB 3.48Å; F527-Y531 PolarHBondContact O-N 3.44Å; W528-Y531 HydrophobicContact CE3-CD1 4.16Å; W528-Y531 HydrophobicContact CE3-CG 4.48Å; W528-Y531 HydrophobicContact CZ3-CD1 4.09Å; W528-Y531 HydrophobicContact CZ3-CE1 4.35Å; W528-Y531 PolarHBondContact O-N 3.16Å; M529-Y531 VanDerWaalsContact C-N 3.29Å; M529-Y531 PolarHBondContact O-N 2.77Å; Y531-S535 PolarHBondContact O-N 2.64Å; Y531-S535 VanDerWaalsContact O-N 3.13Å; Y531-S535 PolarHBondContact O-OG 3.31Å; Y531-P548 HydrophobicContact CD2-CB 4.26Å; Y531-P548 HydrophobicContact CD2-CG 4.49Å; Y531-P548 WeakPolarHBondContact CD2-O 3.44Å; Y531-L550 HydrophobicContact CE2-CG 4.46Å; Y531-F624 PolarHBondContact OH-O 2.95Å; Y531-P625 HydrophobicContact CD2-CG 3.93Å; Y531-P625 HydrophobicContact CE2-CB 4.34Å; Y531-P625 HydrophobicContact CE2-CG 3.95Å; Y531-P625 HydrophobicContact CG-CG 4.49Å
532	F	81.3	Confident	76.1	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-76.5	-32.4	178.4	-68	-48	0	0	0	113.4	A450 M453 W461 L494 I498 W528 M529 D530 S535 T536	A450-F532 HydrophobicContact CB-CE2 3.64Å; A450-F532 HydrophobicContact CB-CZ 4.01Å; M453-F532 HydrophobicContact CB-CE1 4.43Å; M453-F532 HydrophobicContact CB-CZ 3.96Å; M453-F532 HydrophobicContact CE-CE1 4.33Å; M453-F532 HydrophobicContact CE-CE2 4.24Å; M453-F532 HydrophobicContact CE-CZ 3.98Å; M453-F532 HydrophobicContact SD-CE2 4.41Å; M453-F532 HydrophobicContact SD-CZ 4.22Å; W461-F532 HydrophobicContact CH2-CD1 4.29Å; W461-F532 HydrophobicContact CH2-CE1 4.09Å; W461-F532 HydrophobicContact CZ2-CD1 4.29Å; W461-F532 HydrophobicContact CZ2-CE1 4.49Å; L494-F532 HydrophobicContact CD1-CB 4.24Å; L494-F532 HydrophobicContact CD1-CD1 4.23Å; L494-F532 HydrophobicContact CD1-CG 4.21Å; L494-F532 HydrophobicContact CD2-CD1 4.44Å; I498-F532 HydrophobicContact CD1-CB 3.85Å; I498-F532 VanDerWaalsContact CD1-O 3.28Å; I498-F532 WeakPolarHBondContact CD1-O 3.16Å; I498-F532 HydrophobicContact CG1-CB 4.27Å; W528-F532 HydrophobicContact CB-CE2 4.36Å; W528-F532 HydrophobicContact CE3-CE2 4.1Å; W528-F532 AromaticContact CE3-CZ 4Å; W528-F532 HydrophobicContact CE3-CZ 4Å; W528-F532 HydrophobicContact CZ3-CZ 4.36Å; W528-F532 WeakPolarHBondContact O-CB 3.42Å; W528-F532 WeakPolarHBondContact O-CD2 3.39Å; W528-F532 WeakPolarHBondContact O-CG 3.31Å; W528-F532 PolarHBondContact O-N 3.46Å; M529-F532 HydrophobicContact CE-CD2 3.84Å; M529-F532 PolarHBondContact O-N 3.42Å; D530-F532 PolarHBondContact O-N 3.41Å; F532-S535 VanDerWaalsContact O-CB 3.25Å; F532-S535 WeakPolarHBondContact O-CB 3.41Å; F532-S535 PolarHBondContact O-N 2.94Å; F532-T536 PolarHBondContact O-N 3.24Å
533	V	75	Confident	75.7	Confident	47 Å²	47	51 Å²	51	29%	0.285	26%	0.26	S	S	.	.	H	α-helix	trans	-66.4	-47.1	174.6	168.5	0	0	0	0	110.2	I498 M529 D530 S535 T536	I498-V533 HydrophobicContact CG2-CG2 3.63Å; M529-V533 VanDerWaalsContact O-CB 3.24Å; M529-V533 WeakPolarHBondContact O-CB 3.02Å; M529-V533 WeakPolarHBondContact O-CG2 3.4Å; M529-V533 PolarHBondContact O-N 3.12Å; D530-V533 PolarHBondContact O-N 3.03Å; V533-S535 PolarHBondContact O-N 2.77Å; V533-T536 WeakPolarHBondContact O-CA 3.19Å; V533-T536 WeakPolarHBondContact O-CB 3.43Å; V533-T536 PolarHBondContact O-N 3.48Å; V533-T536 PolarHBondContact O-OG1 2.83Å
534	E	79.5	Confident	75.7	Confident	27 Å²	27	47.6 Å²	47.6	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-37.4	173.3	-72.2	-47	133.4	0	0	111	D530 T536 K537 P548 P625 H629	D530-E534 WeakPolarHBondContact O-CB 3.49Å; D530-E534 VanDerWaalsContact O-CG 3.29Å; D530-E534 WeakPolarHBondContact O-CG 3.49Å; D530-E534 PolarHBondContact O-N 3.39Å; E534-T536 PolarHBondContact O-N 3.49Å; E534-K537 PolarHBondContact O-N 3.22Å; E534-K537 IonicContact OE1-NZ 2.77Å; E534-K537 PolarHBondContact OE1-NZ 3.23Å; E534-K537 IonicContact OE2-NZ 2.62Å; E534-P548 HydrophobicContact CB-CG 4.14Å; E534-P548 HydrophobicContact CG-CG 3.7Å; E534-P625 HydrophobicContact CB-CB 4.24Å; E534-P625 HydrophobicContact CB-CG 3.97Å; E534-H629 PolarHBondContact O-CE1 3.35Å; E534-H629 PolarHBondContact O-NE2 3.11Å; E534-H629 IonicContact OE2-NE2 2.75Å
535	S	73.5	Confident	75.9	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.7	173	-55.7	0	0	0	0	114.2	W461 Y531 F532 V533 P625	W461-S535 WeakPolarHBondContact CZ2-OG 3.38Å; Y531-S535 PolarHBondContact O-N 2.64Å; Y531-S535 VanDerWaalsContact O-N 3.13Å; Y531-S535 PolarHBondContact O-OG 3.31Å; F532-S535 VanDerWaalsContact O-CB 3.25Å; F532-S535 WeakPolarHBondContact O-CB 3.41Å; F532-S535 PolarHBondContact O-N 2.94Å; V533-S535 PolarHBondContact O-N 2.77Å; S535-P625 WeakPolarHBondContact OG-CB 3.49Å
536	T	67.2	Low	76.3	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.239	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.7	176.2	68.9	0	0	0	0	114.7	I498 F532 V533 E534	I498-T536 HydrophobicContact CD1-CG2 3.65Å; F532-T536 PolarHBondContact O-N 3.24Å; V533-T536 WeakPolarHBondContact O-CA 3.19Å; V533-T536 WeakPolarHBondContact O-CB 3.43Å; V533-T536 PolarHBondContact O-N 3.48Å; V533-T536 PolarHBondContact O-OG1 2.83Å; E534-T536 PolarHBondContact O-N 3.49Å
537	K	68.7	Low	76.8	Confident	92 Å²	92	51.2 Å²	51.2	40%	0.4	27%	0.265	S	S	.	.			trans	-100.2	9.3	-177.4	-62.4	-177.3	-171.6	164.7	0	114.5	E534 D539 D540	E534-K537 PolarHBondContact O-N 3.22Å; E534-K537 IonicContact OE1-NZ 2.77Å; E534-K537 PolarHBondContact OE1-NZ 3.23Å; E534-K537 IonicContact OE2-NZ 2.62Å; K537-D539 PolarHBondContact O-N 3.17Å; K537-D540 PolarHBondContact O-N 3.13Å
538	A	60.7	Low	76.9	Confident	15 Å²	15	51.4 Å²	51.4	12%	0.124	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-18.4	-165.7	0	0	0	0	0	116.5	T626 S628	A538-T626 HydrophobicContact CB-CG2 4.13Å; A538-S628 PolarHBondContact O-OG 3.34Å
539	D	59.9	Low	77.3	Confident	130 Å²	130	51.2 Å²	51.2	70%	0.695	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-14.8	179.4	-61.5	-34.9	0	0	0	113.8	K537	K537-D539 PolarHBondContact O-N 3.17Å
540	D	65.2	Low	77.8	Confident	127 Å²	127	50.6 Å²	50.6	68%	0.679	26%	0.263	S	S	*	.			trans	-118.9	36.4	-171.1	-79.5	-31.9	0	0	0	114.2	K537 H542	K537-D540 PolarHBondContact O-N 3.13Å; D540-H542 VanDerWaalsContact C-N 3.33Å; D540-H542 PolarHBondContact O-N 3.39Å; D540-H542 VanDerWaalsContact O-N 3.08Å
541	L	68.9	Low	78.2	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.073	25%	0.245	C	C	.	.			trans	-85.7	41.2	-170.9	-67.7	169.7	0	0	0	116	D544 S628 H629 R632	L541-D544 VanDerWaalsContact CD2-OD2 3.3Å; L541-D544 WeakPolarHBondContact CD2-OD2 3.48Å; L541-S628 VanDerWaalsContact CD1-CB 3.45Å; L541-H629 HydrophobicContact CD1-CB 4.45Å; L541-H629 VanDerWaalsContact CD2-CD2 3.5Å; L541-H629 WeakPolarHBondContact CD2-CD2 3.39Å; L541-H629 WeakPolarHBondContact CD2-NE2 3.33Å; L541-R632 WeakPolarHBondContact O-CD 3.42Å; L541-R632 PolarHBondContact O-NE 3.24Å
542	H	65.5	Low	78.1	Confident	155 Å²	155	49.3 Å²	49.3	72%	0.718	26%	0.255	S	S	*	.	S	Bend	trans	-81.5	-35.6	-173.4	-68.3	-62	0	0	0	114.4	D540 R632	D540-H542 VanDerWaalsContact C-N 3.33Å; D540-H542 PolarHBondContact O-N 3.39Å; D540-H542 VanDerWaalsContact O-N 3.08Å; H542-R632 PolarHBondContact O-NH2 3.14Å
543	C	70.5	Confident	77.7	Confident	105 Å²	105	50.8 Å²	50.8	71%	0.709	26%	0.262	S	S	*	.	S	Bend	trans	-112	-1.3	-171.6	56.2	0	0	0	0	115.4	L545	C543-L545 PolarHBondContact O-N 3.15Å
544	D	79.8	Confident	77.1	Confident	40 Å²	40	52.1 Å²	52.1	21%	0.214	27%	0.271	C	S	.	.			trans	-73.3	126	-175.8	-61.9	-51.1	0	0	0	112.3	L541 F547	L541-D544 VanDerWaalsContact CD2-OD2 3.3Å; L541-D544 WeakPolarHBondContact CD2-OD2 3.48Å; D544-F547 HydrophobicContact CB-CE1 4.05Å; D544-F547 HydrophobicContact CB-CZ 4.39Å; D544-F547 WeakPolarHBondContact O-CZ 3.33Å
545	L	87	Confident	76.3	Confident	69 Å²	69	55.2 Å²	55.2	36%	0.361	30%	0.296	S	S	.	.			trans	-113	-9.1	175.4	-64.2	178	0	0	0	112.6	C543 S564 V565 K567 L636	C543-L545 PolarHBondContact O-N 3.15Å; L545-S564 CarbonylContact O-C 3.6Å; L545-S564 WeakPolarHBondContact O-CA 3.47Å; L545-S564 PolarHBondContact O-OG 3.39Å; L545-S564 VanDerWaalsContact O-OG 3.12Å; L545-V565 PolarHBondContact O-N 3.32Å; L545-K567 HydrophobicContact CD2-CD 4.32Å; L545-K567 HydrophobicContact CD2-CG 4.33Å; L545-L636 HydrophobicContact CD2-CD1 4.07Å; L545-L636 HydrophobicContact CD2-CD2 3.79Å
546	R	91.1	Very high	76.4	Confident	124 Å²	124	60.4 Å²	60.4	47%	0.468	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.3	-178	178	-177.9	172.2	-164.5	-6.2	109.7	Y562 V563 W575	R546-Y562 HydrophobicContact CG-CD1 4.35Å; R546-Y562 VanDerWaalsContact NE-CD1 3.34Å; R546-Y562 VanDerWaalsContact NH2-CD1 3.31Å; R546-Y562 VanDerWaalsContact NH2-CZ 3.34Å; R546-V563 CarbonylContact C-O 3.53Å; R546-V563 WeakPolarHBondContact CA-O 3.36Å; R546-W575 HydrophobicContact CG-CH2 4.24Å
547	F	92.6	Very high	76.9	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131	-174.6	-51.2	-83.2	0	0	0	110.7	D544 V549 Y562 V563 F624 H629 R632 F633 L636	D544-F547 HydrophobicContact CB-CE1 4.05Å; D544-F547 HydrophobicContact CB-CZ 4.39Å; D544-F547 WeakPolarHBondContact O-CZ 3.33Å; F547-V549 HydrophobicContact CB-CG1 4.17Å; F547-Y562 WeakPolarHBondContact O-CA 3.5Å; F547-V563 HydrophobicContact CB-CG1 3.87Å; F547-V563 HydrophobicContact CD2-CG1 4.18Å; F547-V563 HydrophobicContact CG-CG1 4.49Å; F547-V563 PolarHBondContact N-O 3.07Å; F547-V563 PolarHBondContact O-N 3.38Å; F547-F624 HydrophobicContact CB-CD1 4.01Å; F547-F624 HydrophobicContact CB-CE1 3.81Å; F547-F624 HydrophobicContact CD2-CE1 4.2Å; F547-F624 HydrophobicContact CG-CD1 4.25Å; F547-F624 AromaticContact CG-CE1 3.91Å; F547-F624 HydrophobicContact CG-CE1 3.91Å; F547-H629 HydrophobicContact CD1-CB 4.33Å; F547-H629 AromaticContact CD1-CD2 4Å; F547-R632 HydrophobicContact CE1-CG 4.22Å; F547-R632 HydrophobicContact CZ-CG 3.97Å; F547-F633 HydrophobicContact CD2-CD2 4.25Å; F547-F633 HydrophobicContact CE2-CB 4.4Å; F547-F633 HydrophobicContact CE2-CD2 4.3Å; F547-L636 HydrophobicContact CE2-CD1 3.81Å; F547-L636 HydrophobicContact CZ-CD1 3.8Å
548	P	92.4	Very high	77.7	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.5	164.8	29.5	-30.7	0	0	0	109.1	F527 D530 Y531 E534 Y562 P625	F527-P548 HydrophobicContact CD2-CB 4.26Å; F527-P548 HydrophobicContact CE2-CB 3.76Å; F527-P548 HydrophobicContact CZ-CB 4.49Å; D530-P548 HydrophobicContact CB-CB 4.35Å; D530-P548 HydrophobicContact CB-CG 4.38Å; Y531-P548 HydrophobicContact CD2-CB 4.26Å; Y531-P548 HydrophobicContact CD2-CG 4.49Å; Y531-P548 WeakPolarHBondContact CD2-O 3.44Å; E534-P548 HydrophobicContact CB-CG 4.14Å; E534-P548 HydrophobicContact CG-CG 3.7Å; P548-Y562 HydrophobicContact CB-CD1 4.09Å; P548-Y562 HydrophobicContact CB-CE1 3.86Å; P548-P625 HydrophobicContact CG-CG 3.98Å; P548-P625 VanDerWaalsContact O-CD 3.31Å; P548-P625 WeakPolarHBondContact O-CD 3.46Å; P548-P625 WeakPolarHBondContact O-CG 3.41Å
549	V	93.9	Very high	79	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.6	-177.8	-62.3	0	0	0	0	111.3	F527 F547 S561 V563 L574 L622 F623 F624	F527-V549 WeakPolarHBondContact CZ-O 3.41Å; F547-V549 HydrophobicContact CB-CG1 4.17Å; V549-S561 CarbonylContact C-O 3.54Å; V549-S561 PolarHBondContact N-O 3.07Å; V549-S561 CarbonylContact O-C 3.58Å; V549-S561 WeakPolarHBondContact O-CA 3.3Å; V549-S561 WeakPolarHBondContact O-CB 3.39Å; V549-S561 PolarHBondContact O-N 3.37Å; V549-V563 HydrophobicContact CB-CG1 4.45Å; V549-V563 HydrophobicContact CG1-CG1 3.6Å; V549-V563 HydrophobicContact CG2-CB 4.1Å; V549-V563 HydrophobicContact CG2-CG1 3.94Å; V549-L574 HydrophobicContact CG2-CD1 4.41Å; V549-L622 HydrophobicContact CB-CB 4.45Å; V549-L622 HydrophobicContact CG2-CD2 4.14Å; V549-F623 CarbonylContact C-O 3.54Å; V549-F623 VanDerWaalsContact CA-O 3.26Å; V549-F623 WeakPolarHBondContact CA-O 3.43Å; V549-F624 HydrophobicContact CG1-CD1 3.62Å; V549-F624 HydrophobicContact CG1-CD2 4.32Å; V549-F624 HydrophobicContact CG1-CE1 3.6Å; V549-F624 HydrophobicContact CG1-CE2 4.29Å; V549-F624 HydrophobicContact CG1-CG 3.99Å; V549-F624 HydrophobicContact CG1-CZ 3.94Å
550	L	92.9	Very high	80.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.5	165.1	-62.4	166.5	0	0	0	108.1	F454 F527 W528 Y531 Y558 P560 L622 F623	F454-L550 HydrophobicContact CB-CD1 4.27Å; F454-L550 HydrophobicContact CD1-CD1 3.52Å; F454-L550 HydrophobicContact CD2-CD1 3.5Å; F454-L550 VanDerWaalsContact CD2-CD1 3.5Å; F454-L550 HydrophobicContact CE1-CD1 3.64Å; F454-L550 HydrophobicContact CE2-CD1 3.61Å; F454-L550 HydrophobicContact CG-CD1 3.46Å; F454-L550 VanDerWaalsContact CG-CD1 3.46Å; F454-L550 HydrophobicContact CZ-CD1 3.69Å; F527-L550 HydrophobicContact CE1-CD2 3.62Å; F527-L550 HydrophobicContact CE1-CG 4.42Å; F527-L550 HydrophobicContact CZ-CD2 3.86Å; F527-L550 HydrophobicContact CZ-CG 4.33Å; W528-L550 HydrophobicContact CH2-CD1 3.56Å; W528-L550 HydrophobicContact CH2-CD2 3.8Å; W528-L550 HydrophobicContact CH2-CG 4.23Å; W528-L550 HydrophobicContact CZ2-CD1 4.5Å; W528-L550 HydrophobicContact CZ2-CD2 4.01Å; W528-L550 HydrophobicContact CZ3-CD1 4Å; W528-L550 HydrophobicContact CZ3-CD2 4.41Å; Y531-L550 HydrophobicContact CE2-CG 4.46Å; L550-Y558 HydrophobicContact CB-CD1 4.36Å; L550-P560 HydrophobicContact CD2-CG 4.27Å; L550-L622 CarbonylContact O-C 3.59Å; L550-L622 WeakPolarHBondContact O-CA 3.28Å; L550-F623 HydrophobicContact CB-CB 4.2Å; L550-F623 PolarHBondContact N-O 3.45Å; L550-F623 WeakPolarHBondContact O-CD2 3.3Å; L550-F623 PolarHBondContact O-N 2.87Å
551	S	89.4	Confident	81.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.5	170.6	-172.5	0	0	0	0	109	T559 S561 M621	S551-T559 PolarHBondContact N-O 3.09Å; S551-T559 PolarHBondContact O-N 3.42Å; S551-S561 WeakPolarHBondContact CB-OG 3.45Å; S551-M621 WeakPolarHBondContact CA-O 3.29Å
552	M	85.3	Confident	83	Confident	41 Å²	41	48.5 Å²	48.5	20%	0.202	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122.2	173.5	-170	176.9	85.5	0	0	110.8	M621 F623	M552-M621 HydrophobicContact CB-CB 4.35Å; M552-M621 HydrophobicContact CB-CE 3.95Å; M552-M621 HydrophobicContact CE-CE 3.04Å; M552-M621 HydrophobicContact CG-CE 4.23Å; M552-M621 PolarHBondContact N-O 3.46Å; M552-M621 HydrophobicContact SD-CE 3.26Å; M552-M621 WeakPolarHBondContact SD-CE 3.46Å; M552-F623 HydrophobicContact CB-CE2 3.97Å
553	E	72	Confident	84.3	Confident	32 Å²	32	41.1 Å²	41.1	15%	0.15	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-74.3	159.6	175.5	-65.9	-66.6	173.1	0	0	111.8	S555 K556 A557 T559 H576 R846	E553-S555 WeakPolarHBondContact CB-OG 3.39Å; E553-S555 PolarHBondContact O-N 2.66Å; E553-S555 VanDerWaalsContact O-N 3.07Å; E553-K556 WeakPolarHBondContact O-CA 3.33Å; E553-K556 PolarHBondContact O-N 2.82Å; E553-A557 HydrophobicContact CB-CB 4.46Å; E553-A557 PolarHBondContact N-O 3.16Å; E553-T559 VanDerWaalsContact CG-OG1 3.25Å; E553-T559 WeakPolarHBondContact CG-OG1 3.3Å; E553-T559 PolarHBondContact OE1-OG1 2.95Å; E553-H576 IonicContact OE1-CD2 3.18Å; E553-H576 IonicContact OE1-NE2 3.8Å; E553-H576 PolarHBondContact OE1-NE2 3.15Å; E553-R846 IonicContact OE2-CZ 3.34Å; E553-R846 IonicContact OE2-NH1 3.79Å; E553-R846 PolarHBondContact OE2-NH1 2.91Å; E553-R846 IonicContact OE2-NH2 2.9Å
554	P	63.5	Low	85.4	Confident	75 Å²	75	37.4 Å²	37.4	49%	0.487	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.3	171.6	-24.3	34.7	0	0	0	113.3	K556 R846	P554-K556 PolarHBondContact O-N 3.46Å; P554-R846 VanDerWaalsContact CD-CZ 3.49Å; P554-R846 VanDerWaalsContact CD-NH2 3.3Å
555	S	63	Low	86	Confident	93 Å²	93	35.5 Å²	35.5	65%	0.65	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	1.5	171.6	58.3	0	0	0	0	114	E553 A557	E553-S555 WeakPolarHBondContact CB-OG 3.39Å; E553-S555 PolarHBondContact O-N 2.66Å; E553-S555 VanDerWaalsContact O-N 3.07Å; S555-A557 PolarHBondContact O-N 2.87Å
556	K	74.6	Confident	86.2	Confident	112 Å²	112	34.3 Å²	34.3	49%	0.487	18%	0.182	S	C	.	.	S	Bend	trans	62.8	19.3	-171.8	-54.5	-171.8	173.7	-166.2	0	114.5	E553 P554 N703	E553-K556 WeakPolarHBondContact O-CA 3.33Å; E553-K556 PolarHBondContact O-N 2.82Å; P554-K556 PolarHBondContact O-N 3.46Å; K556-N703 PolarHBondContact NZ-ND2 3.22Å
557	A	77.2	Confident	85.9	Confident	46 Å²	46	31.6 Å²	31.6	38%	0.38	17%	0.174	S	C	.	.			trans	-84.7	141.7	171.5	0	0	0	0	0	110.9	E553 S555	E553-A557 HydrophobicContact CB-CB 4.46Å; E553-A557 PolarHBondContact N-O 3.16Å; S555-A557 PolarHBondContact O-N 2.87Å
558	Y	86.9	Confident	85.6	Confident	64 Å²	64	38.6 Å²	38.6	25%	0.251	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.1	173.3	-62.3	-74.9	0	0	0	110.3	F454 I455 L550 F623	F454-Y558 AromaticContact CE1-CD1 3.86Å; F454-Y558 HydrophobicContact CE1-CD1 3.86Å; F454-Y558 HydrophobicContact CE1-CD2 4.37Å; F454-Y558 AromaticContact CE1-CE1 3.61Å; F454-Y558 HydrophobicContact CE1-CE1 3.61Å; F454-Y558 HydrophobicContact CE1-CE2 4.14Å; F454-Y558 HydrophobicContact CE1-CG 4.24Å; F454-Y558 AromaticContact CE1-CZ 3.76Å; F454-Y558 HydrophobicContact CZ-CD1 4.44Å; F454-Y558 HydrophobicContact CZ-CE1 4.14Å; I455-Y558 HydrophobicContact CD1-CE2 4.24Å; I455-Y558 HydrophobicContact CG1-CE2 4.02Å; L550-Y558 HydrophobicContact CB-CD1 4.36Å; Y558-F623 HydrophobicContact CD1-CD2 4.34Å; Y558-F623 HydrophobicContact CD1-CE2 4.26Å; Y558-F623 HydrophobicContact CE1-CD2 4.12Å; Y558-F623 AromaticContact CE1-CE2 3.72Å; Y558-F623 HydrophobicContact CE1-CE2 3.72Å; Y558-F623 AromaticContact CE1-CZ 3.95Å; Y558-F623 HydrophobicContact CE1-CZ 3.95Å
559	T	87.6	Confident	85.3	Confident	25 Å²	25	43.6 Å²	43.6	15%	0.153	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115	178.5	-59.3	0	0	0	0	110.2	S551 E553 S561 H576	S551-T559 PolarHBondContact N-O 3.09Å; S551-T559 PolarHBondContact O-N 3.42Å; E553-T559 VanDerWaalsContact CG-OG1 3.25Å; E553-T559 WeakPolarHBondContact CG-OG1 3.3Å; E553-T559 PolarHBondContact OE1-OG1 2.95Å; T559-S561 PolarHBondContact O-N 3.43Å; T559-S561 PolarHBondContact O-OG 3.11Å; T559-H576 HydrophobicContact CG2-CB 3.85Å
560	P	91.1	Very high	85.1	Confident	10 Å²	10	47.5 Å²	47.5	7%	0.065	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.4	124.1	167	-35.2	42.2	0	0	0	112.9	F527 L550 V577	F527-P560 HydrophobicContact CB-CB 4.48Å; F527-P560 HydrophobicContact CD1-CB 3.46Å; F527-P560 VanDerWaalsContact CD1-CB 3.46Å; F527-P560 HydrophobicContact CD1-CG 3.89Å; F527-P560 HydrophobicContact CD2-CB 4.16Å; F527-P560 HydrophobicContact CE1-CB 3.64Å; F527-P560 HydrophobicContact CE1-CG 3.98Å; F527-P560 HydrophobicContact CE2-CB 4.32Å; F527-P560 HydrophobicContact CG-CB 3.74Å; F527-P560 HydrophobicContact CZ-CB 4.07Å; L550-P560 HydrophobicContact CD2-CG 4.27Å; P560-V577 HydrophobicContact CB-CB 3.98Å; P560-V577 HydrophobicContact CB-CG2 4.23Å; P560-V577 WeakPolarHBondContact O-CB 3.1Å; P560-V577 PolarHBondContact O-N 3.02Å
561	S	92.8	Very high	84.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	159.4	-173.6	-53	0	0	0	0	111.2	F527 V549 S551 T559 W575 H576	F527-S561 WeakPolarHBondContact CE2-O 3.43Å; V549-S561 CarbonylContact C-O 3.54Å; V549-S561 PolarHBondContact N-O 3.07Å; V549-S561 CarbonylContact O-C 3.58Å; V549-S561 WeakPolarHBondContact O-CA 3.3Å; V549-S561 WeakPolarHBondContact O-CB 3.39Å; V549-S561 PolarHBondContact O-N 3.37Å; S551-S561 WeakPolarHBondContact CB-OG 3.45Å; T559-S561 PolarHBondContact O-N 3.43Å; T559-S561 PolarHBondContact O-OG 3.11Å; S561-W575 CarbonylContact C-O 3.51Å; S561-W575 WeakPolarHBondContact CA-O 3.48Å; S561-W575 WeakPolarHBondContact CB-O 3.24Å; S561-H576 PolarHBondContact OG-ND1 3.18Å
562	Y	93.8	Very high	85.1	Confident	22 Å²	22	48.1 Å²	48.1	9%	0.086	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.9	165.2	-67.8	-93.3	0	0	0	109	F527 D530 R546 F547 P548 L574 W575 V577	F527-Y562 HydrophobicContact CD2-CD2 4.49Å; F527-Y562 AromaticContact CD2-CE2 3.91Å; F527-Y562 HydrophobicContact CD2-CE2 3.91Å; F527-Y562 AromaticContact CD2-CZ 3.92Å; D530-Y562 PolarHBondContact OD2-OH 3.49Å; R546-Y562 HydrophobicContact CG-CD1 4.35Å; R546-Y562 VanDerWaalsContact NE-CD1 3.34Å; R546-Y562 VanDerWaalsContact NH2-CD1 3.31Å; R546-Y562 VanDerWaalsContact NH2-CZ 3.34Å; F547-Y562 WeakPolarHBondContact O-CA 3.5Å; P548-Y562 HydrophobicContact CB-CD1 4.09Å; P548-Y562 HydrophobicContact CB-CE1 3.86Å; Y562-L574 WeakPolarHBondContact O-CA 3.49Å; Y562-W575 VanDerWaalsContact CB-CE2 3.42Å; Y562-W575 HydrophobicContact CD2-CZ2 4.22Å; Y562-W575 AromaticContact CD2-NE1 3.68Å; Y562-W575 AromaticContact CG-CZ2 3.85Å; Y562-W575 HydrophobicContact CG-CZ2 3.85Å; Y562-W575 PolarHBondContact N-O 3.27Å; Y562-W575 PolarHBondContact O-N 3.4Å; Y562-V577 HydrophobicContact CD2-CG2 3.79Å; Y562-V577 HydrophobicContact CE2-CG2 3.63Å
563	V	94	Very high	85.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.5	170.6	66.9	0	0	0	0	108.8	R546 F547 V549 I572 F573 L574 L622 F624 F633	R546-V563 CarbonylContact C-O 3.53Å; R546-V563 WeakPolarHBondContact CA-O 3.36Å; F547-V563 HydrophobicContact CB-CG1 3.87Å; F547-V563 HydrophobicContact CD2-CG1 4.18Å; F547-V563 HydrophobicContact CG-CG1 4.49Å; F547-V563 PolarHBondContact N-O 3.07Å; F547-V563 PolarHBondContact O-N 3.38Å; V549-V563 HydrophobicContact CB-CG1 4.45Å; V549-V563 HydrophobicContact CG1-CG1 3.6Å; V549-V563 HydrophobicContact CG2-CB 4.1Å; V549-V563 HydrophobicContact CG2-CG1 3.94Å; V563-I572 HydrophobicContact CG2-CG2 3.54Å; V563-F573 CarbonylContact C-O 3.55Å; V563-F573 VanDerWaalsContact CA-O 3.25Å; V563-F573 WeakPolarHBondContact CA-O 3.49Å; V563-L574 HydrophobicContact CB-CD1 4.19Å; V563-L622 HydrophobicContact CB-CD1 4.43Å; V563-L622 HydrophobicContact CG2-CD1 4.26Å; V563-F624 HydrophobicContact CG1-CE1 3.89Å; V563-F624 HydrophobicContact CG1-CZ 3.99Å; V563-F633 HydrophobicContact CG1-CD2 4.33Å; V563-F633 HydrophobicContact CG1-CE2 4.22Å; V563-F633 HydrophobicContact CG2-CD2 4.49Å; V563-F633 HydrophobicContact CG2-CE2 3.64Å; V563-F633 HydrophobicContact CG2-CZ 4.2Å
564	S	93.1	Very high	86.3	Confident	26 Å²	26	46.9 Å²	46.9	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.9	177.2	-164.7	0	0	0	0	109.8	L545 I572 F573	L545-S564 CarbonylContact O-C 3.6Å; L545-S564 WeakPolarHBondContact O-CA 3.47Å; L545-S564 PolarHBondContact O-OG 3.39Å; L545-S564 VanDerWaalsContact O-OG 3.12Å; S564-I572 CarbonylContact O-C 3.57Å; S564-I572 WeakPolarHBondContact O-CA 3.46Å; S564-F573 PolarHBondContact N-O 2.98Å; S564-F573 PolarHBondContact O-N 3.2Å
565	V	92.2	Very high	87.5	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.9	174.1	-173.7	0	0	0	0	108.4	L545 I572 F633 L636 I640	L545-V565 PolarHBondContact O-N 3.32Å; V565-I572 HydrophobicContact CG2-CG1 4.44Å; V565-F633 HydrophobicContact CG2-CD2 3.82Å; V565-F633 HydrophobicContact CG2-CE2 3.69Å; V565-L636 HydrophobicContact CB-CB 4.16Å; V565-L636 HydrophobicContact CB-CD1 4.3Å; V565-L636 HydrophobicContact CG1-CB 4.07Å; V565-L636 HydrophobicContact CG2-CB 4.09Å; V565-L636 HydrophobicContact CG2-CD1 4.35Å; V565-I640 HydrophobicContact CG1-CD1 3.98Å; V565-I640 HydrophobicContact CG1-CG1 4.49Å; V565-I640 HydrophobicContact CG1-CG2 3.99Å
566	N	90.2	Very high	88.7	Confident	43 Å²	43	42.7 Å²	42.7	23%	0.23	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.5	171.1	-174.4	-11.6	0	0	0	108.9	D568 D569 K570 T571 F573	N566-D568 PolarHBondContact OD1-N 3.35Å; N566-D569 HydrophobicContact CB-CB 4.48Å; N566-D569 PolarHBondContact ND2-OD2 3.27Å; N566-D569 PolarHBondContact OD1-N 3.33Å; N566-K570 WeakPolarHBondContact O-CA 3.32Å; N566-K570 PolarHBondContact O-N 2.8Å; N566-K570 VanDerWaalsContact O-N 3.12Å; N566-T571 PolarHBondContact N-O 3.24Å; N566-T571 PolarHBondContact O-N 2.85Å; N566-T571 VanDerWaalsContact O-N 3.1Å; N566-F573 HydrophobicContact CB-CD2 4.33Å; N566-F573 HydrophobicContact CB-CE2 3.95Å
567	K	86	Confident	89.1	Confident	67 Å²	67	38.1 Å²	38.1	29%	0.291	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-36.9	-179.9	-66.8	-173.7	167.7	-148.5	0	112.7	L545 L636 E639	L545-K567 HydrophobicContact CD2-CD 4.32Å; L545-K567 HydrophobicContact CD2-CG 4.33Å; K567-L636 HydrophobicContact CD-CD2 4.49Å; K567-E639 VanDerWaalsContact CE-OE2 3.32Å; K567-E639 WeakPolarHBondContact CE-OE2 3.34Å; K567-E639 IonicContact NZ-OE1 2.77Å; K567-E639 PolarHBondContact NZ-OE1 3Å; K567-E639 IonicContact NZ-OE2 3.21Å; K567-E639 PolarHBondContact NZ-OE2 3.3Å
568	D	84.9	Confident	88.7	Confident	150 Å²	150	39 Å²	39	80%	0.802	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-46.4	-174.7	-61.5	-33.4	0	0	0	110.6	N566 K570	N566-D568 PolarHBondContact OD1-N 3.35Å; D568-K570 VanDerWaalsContact C-N 3.33Å
569	D	86.9	Confident	87.5	Confident	108 Å²	108	40.2 Å²	40.2	58%	0.578	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.1	179.2	-67.1	-27.4	0	0	0	113.2	N566 T571	N566-D569 HydrophobicContact CB-CB 4.48Å; N566-D569 PolarHBondContact ND2-OD2 3.27Å; N566-D569 PolarHBondContact OD1-N 3.33Å; D569-T571 VanDerWaalsContact C-N 3.31Å; D569-T571 HydrophobicContact CB-CG2 4.24Å; D569-T571 WeakPolarHBondContact CB-OG1 3.42Å; D569-T571 WeakPolarHBondContact O-CG2 3.45Å; D569-T571 PolarHBondContact O-N 3.04Å
570	K	88.7	Confident	85.9	Confident	82 Å²	82	43.5 Å²	43.5	36%	0.357	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	51.6	-172.2	-60.4	-173.6	177.2	-168.2	0	112.7	N566 D568 A593 I640	N566-K570 WeakPolarHBondContact O-CA 3.32Å; N566-K570 PolarHBondContact O-N 2.8Å; N566-K570 VanDerWaalsContact O-N 3.12Å; D568-K570 VanDerWaalsContact C-N 3.33Å; K570-A593 HydrophobicContact CB-CB 4.14Å; K570-A593 WeakPolarHBondContact O-CB 3.44Å; K570-A593 PolarHBondContact O-N 3.32Å; K570-I640 HydrophobicContact CB-CB 4.25Å; K570-I640 HydrophobicContact CG-CB 4.43Å
571	T	90.1	Very high	83.7	Confident	13 Å²	13	49.2 Å²	49.2	8%	0.08	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.5	-175.8	46	0	0	0	0	111.8	N566 D569 F573 I590 F591 P592	N566-T571 PolarHBondContact N-O 3.24Å; N566-T571 PolarHBondContact O-N 2.85Å; N566-T571 VanDerWaalsContact O-N 3.1Å; D569-T571 VanDerWaalsContact C-N 3.31Å; D569-T571 HydrophobicContact CB-CG2 4.24Å; D569-T571 WeakPolarHBondContact CB-OG1 3.42Å; D569-T571 WeakPolarHBondContact O-CG2 3.45Å; D569-T571 PolarHBondContact O-N 3.04Å; T571-F573 WeakPolarHBondContact OG1-CE2 3.42Å; T571-I590 HydrophobicContact CG2-CG2 4.05Å; T571-F591 CarbonylContact C-O 3.57Å; T571-F591 WeakPolarHBondContact CA-O 3.47Å; T571-P592 HydrophobicContact CG2-CB 4.3Å; T571-P592 HydrophobicContact CG2-CG 4.34Å
572	I	92.2	Very high	81.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.1	167.2	-57	179.8	0	0	0	108.3	V563 S564 V565 F591 I596 L611 F633 V637 I640	V563-I572 HydrophobicContact CG2-CG2 3.54Å; S564-I572 CarbonylContact O-C 3.57Å; S564-I572 WeakPolarHBondContact O-CA 3.46Å; V565-I572 HydrophobicContact CG2-CG1 4.44Å; I572-F591 HydrophobicContact CB-CB 4.3Å; I572-F591 HydrophobicContact CB-CD2 4.45Å; I572-F591 HydrophobicContact CG2-CD2 4.48Å; I572-F591 PolarHBondContact N-O 3.24Å; I572-F591 PolarHBondContact O-N 3.04Å; I572-I596 HydrophobicContact CD1-CD1 3.39Å; I572-I596 HydrophobicContact CD1-CG1 4.4Å; I572-I596 HydrophobicContact CG1-CD1 3.86Å; I572-L611 HydrophobicContact CD1-CD1 4.28Å; I572-F633 HydrophobicContact CD1-CE2 4.5Å; I572-F633 HydrophobicContact CD1-CZ 4.12Å; I572-F633 HydrophobicContact CG2-CE2 4.43Å; I572-V637 HydrophobicContact CD1-CG2 3.77Å; I572-I640 HydrophobicContact CD1-CD1 4.29Å; I572-I640 HydrophobicContact CG1-CD1 3.8Å
573	F	91.6	Very high	79.2	Confident	48 Å²	48	63.2 Å²	63.2	21%	0.211	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.7	171.5	-69.5	-93.4	0	0	0	109.3	V563 S564 N566 T571 W575 I590	V563-F573 CarbonylContact C-O 3.55Å; V563-F573 VanDerWaalsContact CA-O 3.25Å; V563-F573 WeakPolarHBondContact CA-O 3.49Å; S564-F573 PolarHBondContact N-O 2.98Å; S564-F573 PolarHBondContact O-N 3.2Å; N566-F573 HydrophobicContact CB-CD2 4.33Å; N566-F573 HydrophobicContact CB-CE2 3.95Å; T571-F573 WeakPolarHBondContact OG1-CE2 3.42Å; F573-W575 HydrophobicContact CB-CE3 4.24Å; F573-W575 HydrophobicContact CB-CZ3 4.02Å; F573-I590 HydrophobicContact CD1-CB 4.35Å; F573-I590 HydrophobicContact CD1-CD1 4.14Å; F573-I590 HydrophobicContact CD1-CG1 3.65Å; F573-I590 HydrophobicContact CD1-CG2 4.17Å; F573-I590 HydrophobicContact CE1-CB 4.22Å; F573-I590 HydrophobicContact CE1-CD1 3.54Å; F573-I590 HydrophobicContact CE1-CG1 3.53Å; F573-I590 HydrophobicContact CE1-CG2 3.76Å; F573-I590 HydrophobicContact CZ-CD1 4.43Å; F573-I590 HydrophobicContact CZ-CG2 3.95Å
574	L	91.6	Very high	76.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.7	172.6	177	65.6	0	0	0	108.6	V549 Y562 V563 Q588 W589 F591 F620 L622	V549-L574 HydrophobicContact CG2-CD1 4.41Å; Y562-L574 WeakPolarHBondContact O-CA 3.49Å; V563-L574 HydrophobicContact CB-CD1 4.19Å; L574-Q588 CarbonylContact O-C 3.56Å; L574-Q588 WeakPolarHBondContact O-CA 3.46Å; L574-W589 HydrophobicContact CB-CE3 4.47Å; L574-W589 HydrophobicContact CD2-CE3 4.22Å; L574-W589 HydrophobicContact CG-CE3 4.16Å; L574-W589 PolarHBondContact N-O 2.86Å; L574-W589 PolarHBondContact O-N 3.31Å; L574-F591 HydrophobicContact CB-CE2 3.98Å; L574-F591 HydrophobicContact CD2-CE2 4.23Å; L574-F620 HydrophobicContact CD2-CB 4.37Å; L574-F620 HydrophobicContact CD2-CD1 3.39Å; L574-F620 HydrophobicContact CD2-CD2 4.36Å; L574-F620 HydrophobicContact CD2-CE1 3.63Å; L574-F620 HydrophobicContact CD2-CG 3.79Å; L574-F620 HydrophobicContact CD2-CZ 4.23Å; L574-L622 HydrophobicContact CD1-CD2 3.91Å; L574-L622 HydrophobicContact CD2-CD2 4.23Å
575	W	89.6	Confident	74.9	Confident	69 Å²	69	72.4 Å²	72.4	26%	0.261	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	136.8	172.6	66.4	99.3	0	0	0	112	R546 S561 Y562 F573 S587 Q588	R546-W575 HydrophobicContact CG-CH2 4.24Å; S561-W575 CarbonylContact C-O 3.51Å; S561-W575 WeakPolarHBondContact CA-O 3.48Å; S561-W575 WeakPolarHBondContact CB-O 3.24Å; Y562-W575 VanDerWaalsContact CB-CE2 3.42Å; Y562-W575 HydrophobicContact CD2-CZ2 4.22Å; Y562-W575 AromaticContact CD2-NE1 3.68Å; Y562-W575 AromaticContact CG-CZ2 3.85Å; Y562-W575 HydrophobicContact CG-CZ2 3.85Å; Y562-W575 PolarHBondContact N-O 3.27Å; Y562-W575 PolarHBondContact O-N 3.4Å; F573-W575 HydrophobicContact CB-CE3 4.24Å; F573-W575 HydrophobicContact CB-CZ3 4.02Å; W575-S587 CarbonylContact C-O 3.28Å; W575-S587 VanDerWaalsContact CA-O 3.27Å; W575-S587 WeakPolarHBondContact CA-O 3.46Å; W575-Q588 HydrophobicContact CB-CB 4.04Å; W575-Q588 HydrophobicContact CB-CG 4.04Å
576	H	88.3	Confident	73.6	Confident	11 Å²	11	76.4 Å²	76.4	5%	0.051	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	139.2	172.9	-63	-26.3	0	0	0	110.1	E553 T559 S561 T578 S587 W589	E553-H576 IonicContact OE1-CD2 3.18Å; E553-H576 IonicContact OE1-NE2 3.8Å; E553-H576 PolarHBondContact OE1-NE2 3.15Å; T559-H576 HydrophobicContact CG2-CB 3.85Å; S561-H576 PolarHBondContact OG-ND1 3.18Å; H576-T578 HydrophobicContact CB-CG2 3.72Å; H576-T578 PolarHBondContact O-N 2.82Å; H576-T578 PolarHBondContact O-OG1 3.47Å; H576-S587 PolarHBondContact N-O 3.06Å; H576-W589 AromaticContact CD2-CH2 3.4Å; H576-W589 WeakPolarHBondContact CD2-CH2 3.29Å; H576-W589 AromaticContact CD2-CZ3 3.5Å; H576-W589 VanDerWaalsContact CD2-CZ3 3.5Å; H576-W589 WeakPolarHBondContact CD2-CZ3 3.33Å; H576-W589 AromaticContact CE1-CH2 3.91Å; H576-W589 AromaticContact CE1-CZ3 3.66Å; H576-W589 AromaticContact CG-CZ3 3.86Å; H576-W589 AromaticContact ND1-CZ3 3.94Å; H576-W589 AromaticContact NE2-CH2 3.16Å; H576-W589 WeakPolarHBondContact NE2-CH2 3.14Å; H576-W589 AromaticContact NE2-CZ3 3.36Å; H576-W589 WeakPolarHBondContact NE2-CZ3 3.24Å
577	V	82.9	Confident	72.8	Confident	16 Å²	16	76.5 Å²	76.5	10%	0.097	40%	0.4	C	S	.	.			trans	-73.9	77.1	168	-175.9	0	0	0	0	107.4	F527 P560 Y562 Y579	F527-V577 HydrophobicContact CB-CG2 4.43Å; F527-V577 HydrophobicContact CD2-CG2 4.13Å; F527-V577 HydrophobicContact CG-CG2 4.44Å; P560-V577 HydrophobicContact CB-CB 3.98Å; P560-V577 HydrophobicContact CB-CG2 4.23Å; P560-V577 WeakPolarHBondContact O-CB 3.1Å; P560-V577 PolarHBondContact O-N 3.02Å; Y562-V577 HydrophobicContact CD2-CG2 3.79Å; Y562-V577 HydrophobicContact CE2-CG2 3.63Å; V577-Y579 HydrophobicContact CG1-CD2 4.39Å; V577-Y579 HydrophobicContact CG1-CE2 3.42Å; V577-Y579 VanDerWaalsContact CG1-CE2 3.42Å
578	T	69.3	Low	72.6	Confident	64 Å²	64	78.8 Å²	78.8	39%	0.393	41%	0.412	S	S	.	.			trans	-111.4	135.3	179.2	47.5	0	0	0	0	109.8	H576 S587	H576-T578 HydrophobicContact CB-CG2 3.72Å; H576-T578 PolarHBondContact O-N 2.82Å; H576-T578 PolarHBondContact O-OG1 3.47Å; T578-S587 VanDerWaalsContact OG1-CB 3.23Å; T578-S587 WeakPolarHBondContact OG1-CB 3.42Å
579	Y	60.2	Low	72.7	Confident	89 Å²	89	72.8 Å²	72.8	35%	0.349	38%	0.378	S	S	.	.			trans	-125.4	11.6	179.2	-60.4	-64.8	0	0	0	113.7	M520 R523 V577	M520-Y579 WeakPolarHBondContact CE-O 3.29Å; R523-Y579 HydrophobicContact CB-CD2 4.19Å; R523-Y579 HydrophobicContact CB-CE2 3.35Å; R523-Y579 HydrophobicContact CG-CE2 4.19Å; V577-Y579 HydrophobicContact CG1-CD2 4.39Å; V577-Y579 HydrophobicContact CG1-CE2 3.42Å; V577-Y579 VanDerWaalsContact CG1-CE2 3.42Å
580	S	54.5	Low	72.7	Confident	94 Å²	94	72 Å²	72	66%	0.657	37%	0.373	S	S	*	.	S	Bend	trans	-78.7	147.1	167.5	87.6	0	0	0	0	110.6
581	L	45.1	Very low	72.7	Confident	131 Å²	131	68.3 Å²	68.3	69%	0.686	36%	0.356	S	S	*	.			trans	-47.8	141.1	173.2	-81.8	142.4	0	0	0	111.2	K583	L581-K583 VanDerWaalsContact C-N 3.26Å; L581-K583 PolarHBondContact O-N 3.48Å
582	P	43.5	Very low	72.6	Confident	109 Å²	109	69.6 Å²	69.6	71%	0.708	37%	0.365	S	S	*	.	S	Bend	trans	-71.2	80.6	-173.2	31.4	-34.4	0	0	0	109.9
583	K	47.5	Very low	72.3	Confident	206 Å²	206	69.6 Å²	69.6	90%	0.896	37%	0.365	S	S	*	.	S	Bend	trans	-92.3	-18.5	165.4	-73.3	-171.1	175.7	-178.4	0	111.6	L581	L581-K583 VanDerWaalsContact C-N 3.26Å; L581-K583 PolarHBondContact O-N 3.48Å
584	S	47.4	Very low	71.8	Confident	71 Å²	71	73.7 Å²	73.7	50%	0.497	39%	0.385	S	S	.	.	S	Bend	trans	-118.3	118.5	171.6	55.7	0	0	0	0	109.7	F586	S584-F586 PolarHBondContact O-N 3.46Å
585	N	50.3	Low	71.3	Confident	149 Å²	149	74.7 Å²	74.7	80%	0.797	39%	0.392	S	S	*	.	S	Bend	trans	-67.4	23.3	177.8	-76.3	-18.4	0	0	0	114.4
586	F	64	Low	71	Confident	84 Å²	84	71.4 Å²	71.4	37%	0.368	38%	0.38	S	S	.	.			trans	-124.3	50.2	-168.4	-57.7	-69.1	0	0	0	111.5	S584 W589	S584-F586 PolarHBondContact O-N 3.46Å; F586-W589 HydrophobicContact CB-CH2 4.44Å; F586-W589 HydrophobicContact CB-CZ2 3.85Å; F586-W589 WeakPolarHBondContact O-CH2 3.48Å; F586-W589 WeakPolarHBondContact O-CZ2 3.36Å
587	S	74	Confident	70.4	Confident	46 Å²	46	72.5 Å²	72.5	32%	0.322	38%	0.383	S	S	.	.	S	Bend	trans	-107.2	-15.8	173.1	60	0	0	0	0	113.2	W575 H576 T578	W575-S587 CarbonylContact C-O 3.28Å; W575-S587 VanDerWaalsContact CA-O 3.27Å; W575-S587 WeakPolarHBondContact CA-O 3.46Å; H576-S587 PolarHBondContact N-O 3.06Å; T578-S587 VanDerWaalsContact OG1-CB 3.23Å; T578-S587 WeakPolarHBondContact OG1-CB 3.42Å
588	Q	82.3	Confident	70.2	Confident	115 Å²	115	71.7 Å²	71.7	54%	0.537	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	138.3	-176.1	178.7	174.9	-8.1	0	0	109.9	L574 W575	L574-Q588 CarbonylContact O-C 3.56Å; L574-Q588 WeakPolarHBondContact O-CA 3.46Å; W575-Q588 HydrophobicContact CB-CB 4.04Å; W575-Q588 HydrophobicContact CB-CG 4.04Å
589	W	86.4	Confident	71	Confident	23 Å²	23	68.7 Å²	68.7	9%	0.087	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144	178.4	-59.8	-97.9	0	0	0	110.1	L574 H576 F586 F591 F620	L574-W589 HydrophobicContact CB-CE3 4.47Å; L574-W589 HydrophobicContact CD2-CE3 4.22Å; L574-W589 HydrophobicContact CG-CE3 4.16Å; L574-W589 PolarHBondContact N-O 2.86Å; L574-W589 PolarHBondContact O-N 3.31Å; H576-W589 AromaticContact CD2-CH2 3.4Å; H576-W589 WeakPolarHBondContact CD2-CH2 3.29Å; H576-W589 AromaticContact CD2-CZ3 3.5Å; H576-W589 VanDerWaalsContact CD2-CZ3 3.5Å; H576-W589 WeakPolarHBondContact CD2-CZ3 3.33Å; H576-W589 AromaticContact CE1-CH2 3.91Å; H576-W589 AromaticContact CE1-CZ3 3.66Å; H576-W589 AromaticContact CG-CZ3 3.86Å; H576-W589 AromaticContact ND1-CZ3 3.94Å; H576-W589 AromaticContact NE2-CH2 3.16Å; H576-W589 WeakPolarHBondContact NE2-CH2 3.14Å; H576-W589 AromaticContact NE2-CZ3 3.36Å; H576-W589 WeakPolarHBondContact NE2-CZ3 3.24Å; F586-W589 HydrophobicContact CB-CH2 4.44Å; F586-W589 HydrophobicContact CB-CZ2 3.85Å; F586-W589 WeakPolarHBondContact O-CH2 3.48Å; F586-W589 WeakPolarHBondContact O-CZ2 3.36Å; W589-F591 HydrophobicContact CB-CD1 4.47Å; W589-F591 HydrophobicContact CB-CD2 4.26Å; W589-F591 HydrophobicContact CB-CE1 3.76Å; W589-F591 HydrophobicContact CB-CE2 3.51Å; W589-F591 HydrophobicContact CB-CZ 3.21Å; W589-F591 AromaticContact CD1-CZ 3.8Å; W589-F591 HydrophobicContact CG-CE1 4.15Å; W589-F591 HydrophobicContact CG-CE2 4.24Å; W589-F591 AromaticContact CG-CZ 3.57Å; W589-F591 HydrophobicContact CG-CZ 3.57Å; W589-F620 HydrophobicContact CD2-CE1 4.28Å; W589-F620 HydrophobicContact CD2-CZ 4.02Å; W589-F620 AromaticContact CE2-CZ 3.83Å; W589-F620 HydrophobicContact CE3-CE1 4.37Å; W589-F620 HydrophobicContact CG-CZ 4.29Å; W589-F620 HydrophobicContact CH2-CE1 4.26Å; W589-F620 HydrophobicContact CZ2-CE1 4.14Å; W589-F620 HydrophobicContact CZ2-CZ 4.19Å; W589-F620 HydrophobicContact CZ3-CE1 4.38Å; W589-F620 AromaticContact NE1-CZ 3.94Å
590	I	88	Confident	72.1	Confident	92 Å²	92	64.8 Å²	64.8	47%	0.472	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.5	170.1	-51	177	0	0	0	105.2	T571 F573 P592	T571-I590 HydrophobicContact CG2-CG2 4.05Å; F573-I590 HydrophobicContact CD1-CB 4.35Å; F573-I590 HydrophobicContact CD1-CD1 4.14Å; F573-I590 HydrophobicContact CD1-CG1 3.65Å; F573-I590 HydrophobicContact CD1-CG2 4.17Å; F573-I590 HydrophobicContact CE1-CB 4.22Å; F573-I590 HydrophobicContact CE1-CD1 3.54Å; F573-I590 HydrophobicContact CE1-CG1 3.53Å; F573-I590 HydrophobicContact CE1-CG2 3.76Å; F573-I590 HydrophobicContact CZ-CD1 4.43Å; F573-I590 HydrophobicContact CZ-CG2 3.95Å; I590-P592 WeakPolarHBondContact O-CD 3.25Å
591	F	88.6	Confident	73.6	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.018	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	97.1	179.6	-54.6	-63.5	0	0	0	108.8	T571 I572 L574 W589 S595 I596 L611 V613 F620	T571-F591 CarbonylContact C-O 3.57Å; T571-F591 WeakPolarHBondContact CA-O 3.47Å; I572-F591 HydrophobicContact CB-CB 4.3Å; I572-F591 HydrophobicContact CB-CD2 4.45Å; I572-F591 HydrophobicContact CG2-CD2 4.48Å; I572-F591 PolarHBondContact N-O 3.24Å; I572-F591 PolarHBondContact O-N 3.04Å; L574-F591 HydrophobicContact CB-CE2 3.98Å; L574-F591 HydrophobicContact CD2-CE2 4.23Å; W589-F591 HydrophobicContact CB-CD1 4.47Å; W589-F591 HydrophobicContact CB-CD2 4.26Å; W589-F591 HydrophobicContact CB-CE1 3.76Å; W589-F591 HydrophobicContact CB-CE2 3.51Å; W589-F591 HydrophobicContact CB-CZ 3.21Å; W589-F591 AromaticContact CD1-CZ 3.8Å; W589-F591 HydrophobicContact CG-CE1 4.15Å; W589-F591 HydrophobicContact CG-CE2 4.24Å; W589-F591 AromaticContact CG-CZ 3.57Å; W589-F591 HydrophobicContact CG-CZ 3.57Å; F591-S595 VanDerWaalsContact CA-OG 3.29Å; F591-S595 WeakPolarHBondContact CA-OG 3.33Å; F591-S595 WeakPolarHBondContact CB-OG 3.34Å; F591-I596 HydrophobicContact CB-CG1 4.29Å; F591-L611 HydrophobicContact CD2-CD2 4.14Å; F591-L611 HydrophobicContact CE2-CD2 4.11Å; F591-V613 HydrophobicContact CD1-CB 4.12Å; F591-V613 HydrophobicContact CD1-CG1 3.63Å; F591-V613 HydrophobicContact CD1-CG2 4.33Å; F591-V613 HydrophobicContact CD2-CG1 4.36Å; F591-V613 HydrophobicContact CE1-CB 4.1Å; F591-V613 HydrophobicContact CE1-CG1 3.78Å; F591-V613 HydrophobicContact CE1-CG2 3.81Å; F591-V613 HydrophobicContact CE2-CG1 4.47Å; F591-V613 HydrophobicContact CG-CG1 3.93Å; F591-V613 HydrophobicContact CZ-CG1 4.19Å; F591-V613 HydrophobicContact CZ-CG2 4.38Å; F591-F620 HydrophobicContact CE1-CE2 4.26Å; F591-F620 HydrophobicContact CE2-CE2 4.18Å; F591-F620 HydrophobicContact CZ-CD2 4.15Å; F591-F620 AromaticContact CZ-CE2 3.45Å; F591-F620 HydrophobicContact CZ-CE2 3.45Å; F591-F620 VanDerWaalsContact CZ-CE2 3.45Å; F591-F620 AromaticContact CZ-CZ 3.88Å; F591-F620 HydrophobicContact CZ-CZ 3.88Å
592	P	87.8	Confident	75.3	Confident	40 Å²	40	55.8 Å²	55.8	26%	0.26	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	150.1	163.9	-22.9	33.3	0	0	0	110.6	T571 I590 E594 S595	T571-P592 HydrophobicContact CG2-CB 4.3Å; T571-P592 HydrophobicContact CG2-CG 4.34Å; I590-P592 WeakPolarHBondContact O-CD 3.25Å; P592-E594 VanDerWaalsContact CB-CD 3.45Å; P592-E594 HydrophobicContact CB-CG 4.16Å; P592-E594 WeakPolarHBondContact CB-OE1 3.17Å; P592-E594 PolarHBondContact O-N 2.98Å; P592-E594 VanDerWaalsContact O-N 3.14Å; P592-S595 WeakPolarHBondContact CD-OG 3.43Å; P592-S595 WeakPolarHBondContact O-CA 2.98Å; P592-S595 WeakPolarHBondContact O-CB 3.48Å; P592-S595 PolarHBondContact O-N 3.33Å; P592-S595 PolarHBondContact O-OG 2.85Å
593	A	85.6	Confident	76.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-52.8	-37.2	-179.6	0	0	0	0	0	112.4	K570 S595 I596 V644 T647	K570-A593 HydrophobicContact CB-CB 4.14Å; K570-A593 WeakPolarHBondContact O-CB 3.44Å; K570-A593 PolarHBondContact O-N 3.32Å; A593-S595 PolarHBondContact O-N 3.12Å; A593-I596 PolarHBondContact O-N 2.87Å; A593-V644 HydrophobicContact CB-CG2 3.87Å; A593-T647 PolarHBondContact O-OG1 3.49Å
594	E	81.6	Confident	77.8	Confident	134 Å²	134	51.9 Å²	51.9	63%	0.626	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.6	-17.5	175.3	65.2	-95.1	-159.7	0	0	115.2	P592 Y614	P592-E594 VanDerWaalsContact CB-CD 3.45Å; P592-E594 HydrophobicContact CB-CG 4.16Å; P592-E594 WeakPolarHBondContact CB-OE1 3.17Å; P592-E594 PolarHBondContact O-N 2.98Å; P592-E594 VanDerWaalsContact O-N 3.14Å; E594-Y614 WeakPolarHBondContact O-CD2 3.42Å
595	S	81.2	Confident	79.3	Confident	21 Å²	21	49.4 Å²	49.4	15%	0.147	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-89.9	-11.8	177.8	75.6	0	0	0	0	113	F591 P592 A593 V613 Y614	F591-S595 VanDerWaalsContact CA-OG 3.29Å; F591-S595 WeakPolarHBondContact CA-OG 3.33Å; F591-S595 WeakPolarHBondContact CB-OG 3.34Å; P592-S595 WeakPolarHBondContact CD-OG 3.43Å; P592-S595 WeakPolarHBondContact O-CA 2.98Å; P592-S595 WeakPolarHBondContact O-CB 3.48Å; P592-S595 PolarHBondContact O-N 3.33Å; P592-S595 PolarHBondContact O-OG 2.85Å; A593-S595 PolarHBondContact O-N 3.12Å; S595-V613 CarbonylContact O-C 3.57Å; S595-V613 WeakPolarHBondContact O-CA 3.48Å; S595-Y614 WeakPolarHBondContact O-CD2 3.43Å; S595-Y614 PolarHBondContact O-N 3.32Å
596	I	82.7	Confident	80.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	118.3	178.5	-55.6	171.6	0	0	0	107.6	I572 F591 A593 V599 L611 I640 T641 T647	I572-I596 HydrophobicContact CD1-CD1 3.39Å; I572-I596 HydrophobicContact CD1-CG1 4.4Å; I572-I596 HydrophobicContact CG1-CD1 3.86Å; F591-I596 HydrophobicContact CB-CG1 4.29Å; A593-I596 PolarHBondContact O-N 2.87Å; I596-V599 HydrophobicContact CG2-CG2 3.8Å; I596-L611 HydrophobicContact CG2-CD1 4.04Å; I596-I640 HydrophobicContact CD1-CD1 4.24Å; I596-T641 HydrophobicContact CD1-CG2 4.33Å; I596-T647 HydrophobicContact CB-CG2 4.03Å; I596-T647 HydrophobicContact CG2-CG2 3.66Å; I596-T647 PolarHBondContact O-OG1 3.23Å
597	R	75.9	Confident	81.5	Confident	33 Å²	33	39.9 Å²	39.9	13%	0.125	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-47.4	177.6	-178.9	179.2	-175.6	-169.8	3.8	110.5	Y612 Y614 K648 L716 H717	R597-Y612 PolarHBondContact N-O 3.07Å; R597-Y614 HydrophobicContact CB-CD1 4.19Å; R597-Y614 HydrophobicContact CB-CD2 4.17Å; R597-Y614 HydrophobicContact CB-CE1 3.99Å; R597-Y614 HydrophobicContact CB-CE2 3.96Å; R597-Y614 HydrophobicContact CB-CG 4.27Å; R597-Y614 HydrophobicContact CG-CD1 4.31Å; R597-Y614 HydrophobicContact CG-CE1 3.78Å; R597-Y614 HydrophobicContact CG-CE2 4.45Å; R597-K648 PolarHBondContact O-N 3.45Å; R597-K648 VanDerWaalsContact O-N 3.14Å; R597-L716 HydrophobicContact CG-CD1 4.26Å; R597-L716 HydrophobicContact CG-CD2 4.22Å; R597-L716 VanDerWaalsContact CZ-CB 3.49Å; R597-L716 PolarHBondContact NH2-O 2.97Å; R597-H717 PolarHBondContact NH2-CD2 3.03Å; R597-H717 PolarHBondContact NH2-NE2 3.18Å
598	A	79.6	Confident	82.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	160.1	179.6	0	0	0	0	0	111.6	Y612 K648 L650 L716	A598-Y612 HydrophobicContact CB-CD2 3.82Å; A598-Y612 HydrophobicContact CB-CG 4.32Å; A598-Y612 PolarHBondContact N-O 2.98Å; A598-Y612 WeakPolarHBondContact O-CB 3.39Å; A598-Y612 WeakPolarHBondContact O-CD2 3.47Å; A598-Y612 PolarHBondContact O-N 3.27Å; A598-K648 WeakPolarHBondContact CA-O 3.46Å; A598-K648 WeakPolarHBondContact CB-O 2.97Å; A598-L650 HydrophobicContact CB-CD1 3.54Å; A598-L650 HydrophobicContact CB-CG 3.89Å; A598-L716 HydrophobicContact CB-CD1 4.12Å; A598-L716 HydrophobicContact CB-CD2 3.9Å
599	V	85.5	Confident	82.7	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.3	168.8	-176.3	0	0	0	0	108.7	I596 V609 Y610 L611 F633 L634 V637 K648 L649 L650	I596-V599 HydrophobicContact CG2-CG2 3.8Å; V599-V609 HydrophobicContact CG1-CG1 3.36Å; V599-Y610 VanDerWaalsContact CA-O 3.3Å; V599-Y610 WeakPolarHBondContact CA-O 3.16Å; V599-L611 HydrophobicContact CG2-CD1 3.66Å; V599-F633 HydrophobicContact CG1-CE1 4.32Å; V599-L634 HydrophobicContact CG1-CD2 3.5Å; V599-L634 VanDerWaalsContact CG1-CD2 3.5Å; V599-V637 HydrophobicContact CB-CG1 4.13Å; V599-V637 HydrophobicContact CG2-CG1 3.7Å; V599-K648 PolarHBondContact N-O 3.46Å; V599-L649 HydrophobicContact CB-CD2 4.15Å; V599-L650 PolarHBondContact O-N 2.84Å; V599-L650 VanDerWaalsContact O-N 3.09Å
600	S	83.5	Confident	82.7	Confident	7 Å²	7	32.2 Å²	32.2	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	147	178.3	-162.7	0	0	0	0	112.8	V609 Y610 L650 E712	S600-V609 CarbonylContact O-C 3.56Å; S600-V609 VanDerWaalsContact O-CA 3.32Å; S600-V609 WeakPolarHBondContact O-CA 3.39Å; S600-Y610 PolarHBondContact N-O 2.78Å; S600-Y610 PolarHBondContact O-N 2.71Å; S600-L650 PolarHBondContact OG-O 3.29Å; S600-E712 VanDerWaalsContact CB-OE2 3.32Å; S600-E712 WeakPolarHBondContact CB-OE2 3.24Å; S600-E712 PolarHBondContact OG-OE1 2.82Å
601	A	84.8	Confident	82.7	Confident	33 Å²	33	27.8 Å²	27.8	27%	0.273	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.7	171.9	0	0	0	0	0	110.6	K603 L634 Q708	A601-K603 PolarHBondContact O-N 2.95Å; A601-L634 HydrophobicContact CB-CD1 4.09Å; A601-Q708 PolarHBondContact O-NE2 2.93Å
602	A	81.6	Confident	82.4	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.025	13%	0.134	C	C	.	.			trans	-69.8	131.7	173.6	0	0	0	0	0	110.6	D605 A608 Y610 R630	A602-D605 VanDerWaalsContact O-O 3.12Å; A602-A608 HydrophobicContact CB-CB 3.58Å; A602-A608 WeakPolarHBondContact CB-O 3.46Å; A602-A608 PolarHBondContact N-O 2.59Å; A602-Y610 HydrophobicContact CB-CD2 4.33Å; A602-Y610 HydrophobicContact CB-CE2 3.75Å; A602-R630 PolarHBondContact O-NH1 3.15Å
603	K	71.4	Confident	81.9	Confident	110 Å²	110	26 Å²	26	48%	0.478	12%	0.123	S	C	.	.	S	Bend	trans	-78.6	-20.5	-179	-65.9	-171.9	174.3	-155	0	113.9	A601 D652	A601-K603 PolarHBondContact O-N 2.95Å; K603-D652 VanDerWaalsContact CE-OD1 3.23Å; K603-D652 WeakPolarHBondContact CE-OD1 3.42Å; K603-D652 IonicContact NZ-OD1 3.87Å; K603-D652 PolarHBondContact NZ-OD1 3.47Å
604	R	71	Confident	81	Confident	122 Å²	122	29.3 Å²	29.3	46%	0.46	14%	0.136	S	C	.	.	S	Bend	trans	-91.6	-21.4	-177.4	-67.1	178.1	172.7	-110.7	-31.1	113.5	H704 E705	R604-H704 VanDerWaalsContact CZ-CB 3.5Å; R604-H704 PolarHBondContact NE-O 2.77Å; R604-H704 VanDerWaalsContact NH1-C 3.3Å; R604-H704 PolarHBondContact NH2-O 3.47Å; R604-H704 VanDerWaalsContact NH2-O 3.12Å; R604-E705 VanDerWaalsContact NH1-CG 3.32Å; R604-E705 VanDerWaalsContact NH1-N 3.17Å
605	D	79.2	Confident	79.9	Confident	19 Å²	19	27.9 Å²	27.9	10%	0.102	13%	0.132	C	C	.	.			trans	-140.3	110.5	-179.8	-161.3	-46.3	0	0	0	108.9	K457 A602 R607 A608 F623 R630	K457-D605 IonicContact NZ-OD2 3.65Å; A602-D605 VanDerWaalsContact O-O 3.12Å; D605-R607 PolarHBondContact O-N 3.5Å; D605-R607 WeakPolarHBondContact OD1-CB 3.31Å; D605-R607 IonicContact OD1-CZ 3.09Å; D605-R607 PolarHBondContact OD1-N 3.19Å; D605-R607 IonicContact OD1-NE 3.87Å; D605-R607 PolarHBondContact OD1-NE 3.41Å; D605-R607 IonicContact OD1-NH2 3.89Å; D605-R607 PolarHBondContact OD1-NH2 3.01Å; D605-R607 IonicContact OD2-CZ 3.21Å; D605-R607 IonicContact OD2-NE 3.71Å; D605-R607 IonicContact OD2-NH2 3.79Å; D605-R607 PolarHBondContact OD2-NH2 2.81Å; D605-A608 HydrophobicContact CB-CB 4Å; D605-A608 PolarHBondContact O-N 2.99Å; D605-F623 HydrophobicContact CB-CE1 4.32Å; D605-R630 PolarHBondContact O-NH1 2.96Å
606	D	78.6	Confident	78.5	Confident	27 Å²	27	29.1 Å²	29.1	14%	0.144	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-1.8	-178.8	-70.4	-23.8	0	0	0	113.2	S465 D627 R630	S465-D606 WeakPolarHBondContact CB-OD2 3.34Å; S465-D606 PolarHBondContact OG-OD2 2.86Å; D606-D627 HydrophobicContact CB-CB 4.29Å; D606-D627 WeakPolarHBondContact O-CA 3.45Å; D606-D627 WeakPolarHBondContact O-CB 3.37Å; D606-R630 VanDerWaalsContact CA-CZ 3.49Å; D606-R630 VanDerWaalsContact CA-NH1 3.29Å; D606-R630 WeakPolarHBondContact O-CD 3.4Å; D606-R630 PolarHBondContact O-NE 3.29Å; D606-R630 PolarHBondContact O-NH1 3.43Å; D606-R630 PolarHBondContact O-NH2 2.96Å; D606-R630 IonicContact OD1-NH2 2.74Å
607	R	83.6	Confident	77.2	Confident	7 Å²	7	30.7 Å²	30.7	3%	0.026	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-9.2	174.8	-55.1	166	-64.1	160.4	4.7	112.8	W461 D605 F624	W461-R607 VanDerWaalsContact CE3-CD 3.49Å; D605-R607 PolarHBondContact O-N 3.5Å; D605-R607 WeakPolarHBondContact OD1-CB 3.31Å; D605-R607 IonicContact OD1-CZ 3.09Å; D605-R607 PolarHBondContact OD1-N 3.19Å; D605-R607 IonicContact OD1-NE 3.87Å; D605-R607 PolarHBondContact OD1-NE 3.41Å; D605-R607 IonicContact OD1-NH2 3.89Å; D605-R607 PolarHBondContact OD1-NH2 3.01Å; D605-R607 IonicContact OD2-CZ 3.21Å; D605-R607 IonicContact OD2-NE 3.71Å; D605-R607 IonicContact OD2-NH2 3.79Å; D605-R607 PolarHBondContact OD2-NH2 2.81Å; R607-F624 WeakPolarHBondContact CB-O 3.42Å; R607-F624 WeakPolarHBondContact O-CB 3.45Å; R607-F624 WeakPolarHBondContact O-CD2 3.25Å; R607-F624 PolarHBondContact O-N 3.29Å
608	A	89.2	Confident	76.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.4	-170.7	0	0	0	0	0	112.9	A602 D605 M621 L622 F623 R630	A602-A608 HydrophobicContact CB-CB 3.58Å; A602-A608 WeakPolarHBondContact CB-O 3.46Å; A602-A608 PolarHBondContact N-O 2.59Å; D605-A608 HydrophobicContact CB-CB 4Å; D605-A608 PolarHBondContact O-N 2.99Å; A608-M621 HydrophobicContact CB-CG 4.22Å; A608-M621 HydrophobicContact CB-SD 4.21Å; A608-L622 CarbonylContact C-O 3.57Å; A608-L622 VanDerWaalsContact CA-O 3.23Å; A608-L622 WeakPolarHBondContact CA-O 3.26Å; A608-F623 HydrophobicContact CB-CD1 3.7Å; A608-F623 HydrophobicContact CB-CE1 3.73Å; A608-F623 HydrophobicContact CB-CG 4.25Å; A608-F623 HydrophobicContact CB-CZ 4.27Å; A608-R630 WeakPolarHBondContact O-CD 3.32Å
609	V	90.3	Very high	76.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.9	175.8	173.9	0	0	0	0	108.8	V599 S600 M621 L622 F624 R630 F633 L634	V599-V609 HydrophobicContact CG1-CG1 3.36Å; S600-V609 CarbonylContact O-C 3.56Å; S600-V609 VanDerWaalsContact O-CA 3.32Å; S600-V609 WeakPolarHBondContact O-CA 3.39Å; V609-M621 CarbonylContact O-C 3.58Å; V609-M621 WeakPolarHBondContact O-CA 3.31Å; V609-L622 PolarHBondContact N-O 2.85Å; V609-L622 PolarHBondContact O-N 3.02Å; V609-F624 HydrophobicContact CB-CE2 3.96Å; V609-F624 HydrophobicContact CG2-CD2 4.04Å; V609-F624 HydrophobicContact CG2-CE2 3.66Å; V609-R630 HydrophobicContact CG2-CB 4.46Å; V609-R630 HydrophobicContact CG2-CG 3.52Å; V609-F633 HydrophobicContact CG1-CD1 4.39Å; V609-F633 HydrophobicContact CG1-CE1 4.05Å; V609-F633 HydrophobicContact CG2-CD1 4.42Å; V609-L634 HydrophobicContact CG1-CD2 4.19Å; V609-L634 HydrophobicContact CG2-CD2 4.24Å; V609-L634 HydrophobicContact CG2-CG 4.43Å
610	Y	87.6	Confident	76.1	Confident	22 Å²	22	31.7 Å²	31.7	9%	0.086	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.5	163.7	-63.1	-72.8	0	0	0	109.3	V599 S600 A602 Y612 F620 M621 Q708 P709	V599-Y610 VanDerWaalsContact CA-O 3.3Å; V599-Y610 WeakPolarHBondContact CA-O 3.16Å; S600-Y610 PolarHBondContact N-O 2.78Å; S600-Y610 PolarHBondContact O-N 2.71Å; A602-Y610 HydrophobicContact CB-CD2 4.33Å; A602-Y610 HydrophobicContact CB-CE2 3.75Å; Y610-Y612 VanDerWaalsContact CB-CE2 3.43Å; Y610-Y612 HydrophobicContact CG-CE2 4.41Å; Y610-F620 WeakPolarHBondContact CA-O 3.47Å; Y610-M621 HydrophobicContact CD1-CB 4.09Å; Y610-M621 HydrophobicContact CD1-CG 4.25Å; Y610-M621 HydrophobicContact CE1-CB 3.98Å; Y610-M621 HydrophobicContact CE1-CG 3.94Å; Y610-M621 HydrophobicContact CE1-SD 3.65Å; Y610-Q708 HydrophobicContact CE2-CG 4.37Å; Y610-P709 HydrophobicContact CE1-CB 4.5Å; Y610-P709 HydrophobicContact CE1-CG 3.74Å; Y610-P709 HydrophobicContact CE2-CG 4.15Å; Y610-P709 WeakPolarHBondContact OH-CG 3.44Å
611	L	88	Confident	76.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	111.3	170.9	170.4	64	0	0	0	108.1	I572 F591 I596 V599 V613 F620 L622	I572-L611 HydrophobicContact CD1-CD1 4.28Å; F591-L611 HydrophobicContact CD2-CD2 4.14Å; F591-L611 HydrophobicContact CE2-CD2 4.11Å; I596-L611 HydrophobicContact CG2-CD1 4.04Å; V599-L611 HydrophobicContact CG2-CD1 3.66Å; L611-V613 HydrophobicContact CD1-CG1 4.24Å; L611-V613 HydrophobicContact CG-CG1 4.11Å; L611-F620 HydrophobicContact CB-CB 4.25Å; L611-F620 PolarHBondContact N-O 3.18Å; L611-F620 PolarHBondContact O-N 3.38Å; L611-L622 HydrophobicContact CD2-CD1 4.33Å
612	Y	81.2	Confident	76.8	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.008	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.9	178.6	-59.3	-80.7	0	0	0	109.6	R597 A598 Y610 D619 L650 E712 L716	R597-Y612 PolarHBondContact N-O 3.07Å; A598-Y612 HydrophobicContact CB-CD2 3.82Å; A598-Y612 HydrophobicContact CB-CG 4.32Å; A598-Y612 PolarHBondContact N-O 2.98Å; A598-Y612 WeakPolarHBondContact O-CB 3.39Å; A598-Y612 WeakPolarHBondContact O-CD2 3.47Å; A598-Y612 PolarHBondContact O-N 3.27Å; Y610-Y612 VanDerWaalsContact CB-CE2 3.43Å; Y610-Y612 HydrophobicContact CG-CE2 4.41Å; Y612-D619 HydrophobicContact CD1-CB 4.1Å; Y612-D619 VanDerWaalsContact CD1-CG 3.42Å; Y612-D619 VanDerWaalsContact CD1-OD1 3.28Å; Y612-D619 WeakPolarHBondContact CD1-OD1 3.46Å; Y612-D619 HydrophobicContact CE1-CB 4.18Å; Y612-L650 HydrophobicContact CE2-CD1 4.37Å; Y612-E712 HydrophobicContact CE2-CB 4.39Å; Y612-E712 WeakPolarHBondContact CE2-OE2 3.45Å; Y612-E712 PolarHBondContact OH-OE2 2.82Å; Y612-L716 HydrophobicContact CD1-CD1 4.49Å; Y612-L716 HydrophobicContact CG-CD1 4.3Å
613	V	77.7	Confident	77.3	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.018	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.3	178.4	-58.8	0	0	0	0	111.6	F591 S595 L611 L615 D618 F620	F591-V613 HydrophobicContact CD1-CB 4.12Å; F591-V613 HydrophobicContact CD1-CG1 3.63Å; F591-V613 HydrophobicContact CD1-CG2 4.33Å; F591-V613 HydrophobicContact CD2-CG1 4.36Å; F591-V613 HydrophobicContact CE1-CB 4.1Å; F591-V613 HydrophobicContact CE1-CG1 3.78Å; F591-V613 HydrophobicContact CE1-CG2 3.81Å; F591-V613 HydrophobicContact CE2-CG1 4.47Å; F591-V613 HydrophobicContact CG-CG1 3.93Å; F591-V613 HydrophobicContact CZ-CG1 4.19Å; F591-V613 HydrophobicContact CZ-CG2 4.38Å; S595-V613 CarbonylContact O-C 3.57Å; S595-V613 WeakPolarHBondContact O-CA 3.48Å; L611-V613 HydrophobicContact CD1-CG1 4.24Å; L611-V613 HydrophobicContact CG-CG1 4.11Å; V613-L615 VanDerWaalsContact C-N 3.27Å; V613-L615 PolarHBondContact O-N 3.09Å; V613-D618 HydrophobicContact CG2-CB 4.47Å; V613-D618 WeakPolarHBondContact CG2-O 3.26Å; V613-F620 HydrophobicContact CG2-CE2 4.2Å
614	Y	67	Low	78.2	Confident	71 Å²	71	26 Å²	26	28%	0.278	12%	0.124	S	C	.	.	S	Bend	trans	-66.6	-30.8	176.5	-71.2	-69.3	0	0	0	112.1	E594 S595 R597 N616 G646 K788	E594-Y614 WeakPolarHBondContact O-CD2 3.42Å; S595-Y614 WeakPolarHBondContact O-CD2 3.43Å; S595-Y614 PolarHBondContact O-N 3.32Å; R597-Y614 HydrophobicContact CB-CD1 4.19Å; R597-Y614 HydrophobicContact CB-CD2 4.17Å; R597-Y614 HydrophobicContact CB-CE1 3.99Å; R597-Y614 HydrophobicContact CB-CE2 3.96Å; R597-Y614 HydrophobicContact CB-CG 4.27Å; R597-Y614 HydrophobicContact CG-CD1 4.31Å; R597-Y614 HydrophobicContact CG-CE1 3.78Å; R597-Y614 HydrophobicContact CG-CE2 4.45Å; Y614-N616 PolarHBondContact O-N 2.84Å; Y614-G646 PolarHBondContact OH-O 3.46Å; Y614-K788 HydrophobicContact CD1-CB 3.91Å; Y614-K788 HydrophobicContact CD1-CG 4.46Å; Y614-K788 HydrophobicContact CG-CB 4.43Å
615	L	57.6	Low	78.9	Confident	104 Å²	104	20.1 Å²	20.1	55%	0.545	10%	0.102	S	C	.	.	G	3₁₀ helix	trans	-72.7	120.5	-175.1	-160.1	76.9	0	0	0	110.6	V613 S617	V613-L615 VanDerWaalsContact C-N 3.27Å; V613-L615 PolarHBondContact O-N 3.09Å; L615-S617 PolarHBondContact O-N 3.39Å
616	N	53.2	Low	79	Confident	47 Å²	47	19.7 Å²	19.7	25%	0.251	10%	0.1	S	C	.	.	G	3₁₀ helix	trans	60.7	6.5	179.1	-57.1	-30.4	0	0	0	116.4	Y614 D618 R792	Y614-N616 PolarHBondContact O-N 2.84Å; N616-D618 PolarHBondContact O-N 3.45Å; N616-R792 PolarHBondContact O-NH2 3.16Å
617	S	53.8	Low	79.1	Confident	33 Å²	33	18.9 Å²	18.9	23%	0.231	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	46.3	46	-172	-2.4	0	0	0	0	111.9	L615 R792	L615-S617 PolarHBondContact O-N 3.39Å; S617-R792 PolarHBondContact O-NH2 3.32Å; S617-R792 PolarHBondContact OG-NH2 3.4Å; S617-R792 VanDerWaalsContact OG-NH2 3.08Å
618	D	63.3	Low	79.1	Confident	11 Å²	11	20.3 Å²	20.3	6%	0.059	11%	0.106	C	C	.	.			trans	-88	125.9	169.8	-79.6	-46.8	0	0	0	108.8	V613 N616 F620 R846	V613-D618 HydrophobicContact CG2-CB 4.47Å; V613-D618 WeakPolarHBondContact CG2-O 3.26Å; N616-D618 PolarHBondContact O-N 3.45Å; D618-F620 HydrophobicContact CB-CE2 3.85Å; D618-F620 HydrophobicContact CB-CZ 4.14Å; D618-R846 WeakPolarHBondContact OD1-CG 3.33Å; D618-R846 IonicContact OD1-NE 2.64Å; D618-R846 PolarHBondContact OD1-NE 3.07Å; D618-R846 VanDerWaalsContact OD1-NE 3.11Å
619	D	71.9	Confident	79	Confident	45 Å²	45	20.3 Å²	20.3	24%	0.241	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.5	172.4	-56.9	-22	0	0	0	107.7	Y612 R818	Y612-D619 HydrophobicContact CD1-CB 4.1Å; Y612-D619 VanDerWaalsContact CD1-CG 3.42Å; Y612-D619 VanDerWaalsContact CD1-OD1 3.28Å; Y612-D619 WeakPolarHBondContact CD1-OD1 3.46Å; Y612-D619 HydrophobicContact CE1-CB 4.18Å; D619-R818 IonicContact OD2-CZ 3.96Å; D619-R818 VanDerWaalsContact OD2-CZ 3.24Å; D619-R818 IonicContact OD2-NH1 2.68Å; D619-R818 IonicContact OD2-NH2 3.44Å; D619-R818 PolarHBondContact OD2-NH2 3.11Å
620	F	84.6	Confident	79	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.6	177.6	-62.7	-92	0	0	0	108.8	L574 W589 F591 Y610 L611 V613 D618 L622	L574-F620 HydrophobicContact CD2-CB 4.37Å; L574-F620 HydrophobicContact CD2-CD1 3.39Å; L574-F620 HydrophobicContact CD2-CD2 4.36Å; L574-F620 HydrophobicContact CD2-CE1 3.63Å; L574-F620 HydrophobicContact CD2-CG 3.79Å; L574-F620 HydrophobicContact CD2-CZ 4.23Å; W589-F620 HydrophobicContact CD2-CE1 4.28Å; W589-F620 HydrophobicContact CD2-CZ 4.02Å; W589-F620 AromaticContact CE2-CZ 3.83Å; W589-F620 HydrophobicContact CE3-CE1 4.37Å; W589-F620 HydrophobicContact CG-CZ 4.29Å; W589-F620 HydrophobicContact CH2-CE1 4.26Å; W589-F620 HydrophobicContact CZ2-CE1 4.14Å; W589-F620 HydrophobicContact CZ2-CZ 4.19Å; W589-F620 HydrophobicContact CZ3-CE1 4.38Å; W589-F620 AromaticContact NE1-CZ 3.94Å; F591-F620 HydrophobicContact CE1-CE2 4.26Å; F591-F620 HydrophobicContact CE2-CE2 4.18Å; F591-F620 HydrophobicContact CZ-CD2 4.15Å; F591-F620 AromaticContact CZ-CE2 3.45Å; F591-F620 HydrophobicContact CZ-CE2 3.45Å; F591-F620 VanDerWaalsContact CZ-CE2 3.45Å; F591-F620 AromaticContact CZ-CZ 3.88Å; F591-F620 HydrophobicContact CZ-CZ 3.88Å; Y610-F620 WeakPolarHBondContact CA-O 3.47Å; L611-F620 HydrophobicContact CB-CB 4.25Å; L611-F620 PolarHBondContact N-O 3.18Å; L611-F620 PolarHBondContact O-N 3.38Å; V613-F620 HydrophobicContact CG2-CE2 4.2Å; D618-F620 HydrophobicContact CB-CE2 3.85Å; D618-F620 HydrophobicContact CB-CZ 4.14Å; F620-L622 HydrophobicContact CB-CD2 4.1Å; F620-L622 HydrophobicContact CB-CG 4.33Å
621	M	88.5	Confident	78.9	Confident	23 Å²	23	24.1 Å²	24.1	11%	0.113	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.9	162.3	-174.1	168.8	45.3	0	0	108.7	S551 M552 A608 V609 Y610 F623	S551-M621 WeakPolarHBondContact CA-O 3.29Å; M552-M621 HydrophobicContact CB-CB 4.35Å; M552-M621 HydrophobicContact CB-CE 3.95Å; M552-M621 HydrophobicContact CE-CE 3.04Å; M552-M621 HydrophobicContact CG-CE 4.23Å; M552-M621 PolarHBondContact N-O 3.46Å; M552-M621 HydrophobicContact SD-CE 3.26Å; M552-M621 WeakPolarHBondContact SD-CE 3.46Å; A608-M621 HydrophobicContact CB-CG 4.22Å; A608-M621 HydrophobicContact CB-SD 4.21Å; V609-M621 CarbonylContact O-C 3.58Å; V609-M621 WeakPolarHBondContact O-CA 3.31Å; Y610-M621 HydrophobicContact CD1-CB 4.09Å; Y610-M621 HydrophobicContact CD1-CG 4.25Å; Y610-M621 HydrophobicContact CE1-CB 3.98Å; Y610-M621 HydrophobicContact CE1-CG 3.94Å; Y610-M621 HydrophobicContact CE1-SD 3.65Å; M621-F623 HydrophobicContact CB-CE2 4.43Å; M621-F623 HydrophobicContact CE-CE2 3.57Å; M621-F623 HydrophobicContact CE-CZ 3.42Å; M621-F623 VanDerWaalsContact CE-CZ 3.42Å; M621-F623 HydrophobicContact CG-CD2 4.32Å; M621-F623 HydrophobicContact CG-CE2 3.66Å; M621-F623 HydrophobicContact CG-CZ 3.98Å; M621-F623 HydrophobicContact SD-CE1 4.36Å; M621-F623 HydrophobicContact SD-CE2 3.82Å; M621-F623 HydrophobicContact SD-CZ 3.52Å; M621-F623 VanDerWaalsContact SD-CZ 3.52Å
622	L	93	Very high	79	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.9	-178.5	-56.1	-179.6	0	0	0	109.4	V549 L550 V563 L574 A608 V609 L611 F620 F624	V549-L622 HydrophobicContact CB-CB 4.45Å; V549-L622 HydrophobicContact CG2-CD2 4.14Å; L550-L622 CarbonylContact O-C 3.59Å; L550-L622 WeakPolarHBondContact O-CA 3.28Å; V563-L622 HydrophobicContact CB-CD1 4.43Å; V563-L622 HydrophobicContact CG2-CD1 4.26Å; L574-L622 HydrophobicContact CD1-CD2 3.91Å; L574-L622 HydrophobicContact CD2-CD2 4.23Å; A608-L622 CarbonylContact C-O 3.57Å; A608-L622 VanDerWaalsContact CA-O 3.23Å; A608-L622 WeakPolarHBondContact CA-O 3.26Å; V609-L622 PolarHBondContact N-O 2.85Å; V609-L622 PolarHBondContact O-N 3.02Å; L611-L622 HydrophobicContact CD2-CD1 4.33Å; F620-L622 HydrophobicContact CB-CD2 4.1Å; F620-L622 HydrophobicContact CB-CG 4.33Å; L622-F624 HydrophobicContact CB-CE2 4Å
623	F	92	Very high	79.5	Confident	9 Å²	9	26.3 Å²	26.3	4%	0.039	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	113	174.9	-62.9	-101.1	0	0	0	109.7	F454 V549 L550 M552 Y558 D605 A608 M621	F454-F623 HydrophobicContact CE2-CB 3.84Å; F454-F623 HydrophobicContact CE2-CD1 4.19Å; F454-F623 HydrophobicContact CE2-CG 4.21Å; F454-F623 HydrophobicContact CZ-CB 3.78Å; F454-F623 AromaticContact CZ-CD1 3.59Å; F454-F623 HydrophobicContact CZ-CD1 3.59Å; F454-F623 HydrophobicContact CZ-CD2 4.38Å; F454-F623 HydrophobicContact CZ-CE1 4.25Å; F454-F623 AromaticContact CZ-CG 3.66Å; F454-F623 HydrophobicContact CZ-CG 3.66Å; V549-F623 CarbonylContact C-O 3.54Å; V549-F623 VanDerWaalsContact CA-O 3.26Å; V549-F623 WeakPolarHBondContact CA-O 3.43Å; L550-F623 HydrophobicContact CB-CB 4.2Å; L550-F623 PolarHBondContact N-O 3.45Å; L550-F623 WeakPolarHBondContact O-CD2 3.3Å; L550-F623 PolarHBondContact O-N 2.87Å; M552-F623 HydrophobicContact CB-CE2 3.97Å; Y558-F623 HydrophobicContact CD1-CD2 4.34Å; Y558-F623 HydrophobicContact CD1-CE2 4.26Å; Y558-F623 HydrophobicContact CE1-CD2 4.12Å; Y558-F623 AromaticContact CE1-CE2 3.72Å; Y558-F623 HydrophobicContact CE1-CE2 3.72Å; Y558-F623 AromaticContact CE1-CZ 3.95Å; Y558-F623 HydrophobicContact CE1-CZ 3.95Å; D605-F623 HydrophobicContact CB-CE1 4.32Å; A608-F623 HydrophobicContact CB-CD1 3.7Å; A608-F623 HydrophobicContact CB-CE1 3.73Å; A608-F623 HydrophobicContact CB-CG 4.25Å; A608-F623 HydrophobicContact CB-CZ 4.27Å; M621-F623 HydrophobicContact CB-CE2 4.43Å; M621-F623 HydrophobicContact CE-CE2 3.57Å; M621-F623 HydrophobicContact CE-CZ 3.42Å; M621-F623 VanDerWaalsContact CE-CZ 3.42Å; M621-F623 HydrophobicContact CG-CD2 4.32Å; M621-F623 HydrophobicContact CG-CE2 3.66Å; M621-F623 HydrophobicContact CG-CZ 3.98Å; M621-F623 HydrophobicContact SD-CE1 4.36Å; M621-F623 HydrophobicContact SD-CE2 3.82Å; M621-F623 HydrophobicContact SD-CZ 3.52Å; M621-F623 VanDerWaalsContact SD-CZ 3.52Å
624	F	91.7	Very high	80	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.			trans	-78.2	164.3	177	-70.7	-94.5	0	0	0	111.6	Y531 F547 V549 V563 R607 V609 L622 H629 R630 F633	Y531-F624 PolarHBondContact OH-O 2.95Å; F547-F624 HydrophobicContact CB-CD1 4.01Å; F547-F624 HydrophobicContact CB-CE1 3.81Å; F547-F624 HydrophobicContact CD2-CE1 4.2Å; F547-F624 HydrophobicContact CG-CD1 4.25Å; F547-F624 AromaticContact CG-CE1 3.91Å; F547-F624 HydrophobicContact CG-CE1 3.91Å; V549-F624 HydrophobicContact CG1-CD1 3.62Å; V549-F624 HydrophobicContact CG1-CD2 4.32Å; V549-F624 HydrophobicContact CG1-CE1 3.6Å; V549-F624 HydrophobicContact CG1-CE2 4.29Å; V549-F624 HydrophobicContact CG1-CG 3.99Å; V549-F624 HydrophobicContact CG1-CZ 3.94Å; V563-F624 HydrophobicContact CG1-CE1 3.89Å; V563-F624 HydrophobicContact CG1-CZ 3.99Å; R607-F624 WeakPolarHBondContact CB-O 3.42Å; R607-F624 WeakPolarHBondContact O-CB 3.45Å; R607-F624 WeakPolarHBondContact O-CD2 3.25Å; R607-F624 PolarHBondContact O-N 3.29Å; V609-F624 HydrophobicContact CB-CE2 3.96Å; V609-F624 HydrophobicContact CG2-CD2 4.04Å; V609-F624 HydrophobicContact CG2-CE2 3.66Å; L622-F624 HydrophobicContact CB-CE2 4Å; F624-H629 HydrophobicContact CB-CB 4.03Å; F624-H629 HydrophobicContact CD1-CB 4.04Å; F624-H629 HydrophobicContact CG-CB 4.43Å; F624-R630 HydrophobicContact CB-CB 4.35Å; F624-R630 HydrophobicContact CD2-CB 4.21Å; F624-R630 HydrophobicContact CG-CB 4.33Å; F624-F633 HydrophobicContact CD1-CB 4.43Å; F624-F633 HydrophobicContact CE1-CB 3.55Å; F624-F633 HydrophobicContact CE1-CD1 4.34Å; F624-F633 HydrophobicContact CE1-CD2 4.03Å; F624-F633 AromaticContact CE1-CG 3.72Å; F624-F633 HydrophobicContact CE1-CG 3.72Å; F624-F633 HydrophobicContact CE2-CB 4.41Å; F624-F633 AromaticContact CE2-CD1 3.98Å; F624-F633 HydrophobicContact CE2-CD1 3.98Å; F624-F633 HydrophobicContact CE2-CG 4.2Å; F624-F633 HydrophobicContact CZ-CB 3.56Å; F624-F633 AromaticContact CZ-CD1 3.47Å; F624-F633 HydrophobicContact CZ-CD1 3.47Å; F624-F633 VanDerWaalsContact CZ-CD1 3.47Å; F624-F633 AromaticContact CZ-CD2 3.73Å; F624-F633 HydrophobicContact CZ-CD2 3.73Å; F624-F633 HydrophobicContact CZ-CE1 4.04Å; F624-F633 HydrophobicContact CZ-CE2 4.28Å; F624-F633 AromaticContact CZ-CG 3.28Å; F624-F633 HydrophobicContact CZ-CG 3.28Å; F624-F633 HydrophobicContact CZ-CZ 4.41Å
625	P	85.3	Confident	81	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-60.9	-44.3	175.7	-25.1	36.8	0	0	0	112.3	Y531 E534 S535 P548	Y531-P625 HydrophobicContact CD2-CG 3.93Å; Y531-P625 HydrophobicContact CE2-CB 4.34Å; Y531-P625 HydrophobicContact CE2-CG 3.95Å; Y531-P625 HydrophobicContact CG-CG 4.49Å; E534-P625 HydrophobicContact CB-CB 4.24Å; E534-P625 HydrophobicContact CB-CG 3.97Å; S535-P625 WeakPolarHBondContact OG-CB 3.49Å; P548-P625 HydrophobicContact CG-CG 3.98Å; P548-P625 VanDerWaalsContact O-CD 3.31Å; P548-P625 WeakPolarHBondContact O-CD 3.46Å; P548-P625 WeakPolarHBondContact O-CG 3.41Å
626	T	80.4	Confident	82.5	Confident	9 Å²	9	23.7 Å²	23.7	6%	0.055	12%	0.124	C	C	.	.	S	Bend	trans	-141.5	168.2	178.3	76.5	0	0	0	0	112	A538 S628 H629 R630	A538-T626 HydrophobicContact CB-CG2 4.13Å; T626-S628 VanDerWaalsContact C-N 3.27Å; T626-S628 PolarHBondContact O-N 3.18Å; T626-S628 PolarHBondContact OG1-N 3.12Å; T626-H629 PolarHBondContact O-N 3.23Å; T626-H629 PolarHBondContact OG1-N 3.43Å; T626-H629 PolarHBondContact OG1-ND1 3.4Å; T626-R630 PolarHBondContact O-N 3.37Å; T626-R630 VanDerWaalsContact O-N 3.14Å
627	D	81.6	Confident	84.2	Confident	11 Å²	11	21.5 Å²	21.5	6%	0.059	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-34.9	172.7	-174.4	29.7	0	0	0	112.8	S465 D606 H629 R630 H631	S465-D627 WeakPolarHBondContact CB-OD2 3.5Å; D606-D627 HydrophobicContact CB-CB 4.29Å; D606-D627 WeakPolarHBondContact O-CA 3.45Å; D606-D627 WeakPolarHBondContact O-CB 3.37Å; D627-H629 VanDerWaalsContact C-N 3.34Å; D627-H629 PolarHBondContact O-N 3.08Å; D627-R630 WeakPolarHBondContact O-CB 3.39Å; D627-R630 PolarHBondContact O-N 2.88Å; D627-R630 IonicContact OD1-CZ 3.64Å; D627-R630 IonicContact OD1-NE 3.22Å; D627-R630 PolarHBondContact OD1-NE 3.34Å; D627-R630 IonicContact OD1-NH2 2.96Å; D627-R630 PolarHBondContact OD1-NH2 3.26Å; D627-R630 IonicContact OD2-NH2 3.82Å; D627-H631 PolarHBondContact O-N 3.37Å; D627-H631 PolarHBondContact O-ND1 3.45Å; D627-H631 IonicContact OD1-CE1 2.71Å; D627-H631 PolarHBondContact OD1-CE1 3.3Å; D627-H631 IonicContact OD1-ND1 3.78Å; D627-H631 PolarHBondContact OD1-ND1 2.97Å; D627-H631 IonicContact OD2-CE1 2.77Å; D627-H631 PolarHBondContact OD2-CE1 3.39Å; D627-H631 VanDerWaalsContact OD2-CE1 3.26Å; D627-H631 IonicContact OD2-ND1 2.88Å
628	S	82.9	Confident	85.7	Confident	36 Å²	36	23.9 Å²	23.9	25%	0.252	12%	0.122	S	C	.	.	H	α-helix	trans	-62.7	-39.3	175.5	-47	0	0	0	0	112.2	A538 L541 T626 H631 R632	A538-S628 PolarHBondContact O-OG 3.34Å; L541-S628 VanDerWaalsContact CD1-CB 3.45Å; T626-S628 VanDerWaalsContact C-N 3.27Å; T626-S628 PolarHBondContact O-N 3.18Å; T626-S628 PolarHBondContact OG1-N 3.12Å; S628-H631 PolarHBondContact O-N 3.34Å; S628-R632 WeakPolarHBondContact O-CB 3.39Å; S628-R632 PolarHBondContact O-N 3.23Å
629	H	87.8	Confident	86.8	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.8	-39.2	175.2	-64	83.5	0	0	0	111.5	E534 L541 F547 F624 T626 D627 R632 F633	E534-H629 PolarHBondContact O-CE1 3.35Å; E534-H629 PolarHBondContact O-NE2 3.11Å; E534-H629 IonicContact OE2-NE2 2.75Å; L541-H629 HydrophobicContact CD1-CB 4.45Å; L541-H629 VanDerWaalsContact CD2-CD2 3.5Å; L541-H629 WeakPolarHBondContact CD2-CD2 3.39Å; L541-H629 WeakPolarHBondContact CD2-NE2 3.33Å; F547-H629 HydrophobicContact CD1-CB 4.33Å; F547-H629 AromaticContact CD1-CD2 4Å; F624-H629 HydrophobicContact CB-CB 4.03Å; F624-H629 HydrophobicContact CD1-CB 4.04Å; F624-H629 HydrophobicContact CG-CB 4.43Å; T626-H629 PolarHBondContact O-N 3.23Å; T626-H629 PolarHBondContact OG1-N 3.43Å; T626-H629 PolarHBondContact OG1-ND1 3.4Å; D627-H629 VanDerWaalsContact C-N 3.34Å; D627-H629 PolarHBondContact O-N 3.08Å; H629-R632 PolarHBondContact O-N 3.21Å; H629-F633 WeakPolarHBondContact O-CB 3.07Å; H629-F633 PolarHBondContact O-N 3.13Å
630	R	88.7	Confident	87.5	Confident	16 Å²	16	26 Å²	26	6%	0.06	13%	0.13	C	C	.	.	H	α-helix	trans	-57.7	-52.5	172.8	169.5	178.7	79.5	167.7	-0.7	110.7	A602 D605 D606 A608 V609 F624 T626 D627 R632 F633 L634	A602-R630 PolarHBondContact O-NH1 3.15Å; D605-R630 PolarHBondContact O-NH1 2.96Å; D606-R630 VanDerWaalsContact CA-CZ 3.49Å; D606-R630 VanDerWaalsContact CA-NH1 3.29Å; D606-R630 WeakPolarHBondContact O-CD 3.4Å; D606-R630 PolarHBondContact O-NE 3.29Å; D606-R630 PolarHBondContact O-NH1 3.43Å; D606-R630 PolarHBondContact O-NH2 2.96Å; D606-R630 IonicContact OD1-NH2 2.74Å; A608-R630 WeakPolarHBondContact O-CD 3.32Å; V609-R630 HydrophobicContact CG2-CB 4.46Å; V609-R630 HydrophobicContact CG2-CG 3.52Å; F624-R630 HydrophobicContact CB-CB 4.35Å; F624-R630 HydrophobicContact CD2-CB 4.21Å; F624-R630 HydrophobicContact CG-CB 4.33Å; T626-R630 PolarHBondContact O-N 3.37Å; T626-R630 VanDerWaalsContact O-N 3.14Å; D627-R630 WeakPolarHBondContact O-CB 3.39Å; D627-R630 PolarHBondContact O-N 2.88Å; D627-R630 IonicContact OD1-CZ 3.64Å; D627-R630 IonicContact OD1-NE 3.22Å; D627-R630 PolarHBondContact OD1-NE 3.34Å; D627-R630 IonicContact OD1-NH2 2.96Å; D627-R630 PolarHBondContact OD1-NH2 3.26Å; D627-R630 IonicContact OD2-NH2 3.82Å; R630-R632 VanDerWaalsContact C-N 3.33Å; R630-R632 PolarHBondContact O-N 3.21Å; R630-F633 PolarHBondContact O-N 3.43Å; R630-L634 HydrophobicContact CG-CD1 3.98Å; R630-L634 HydrophobicContact CG-CG 4.43Å; R630-L634 WeakPolarHBondContact O-CG 2.98Å; R630-L634 PolarHBondContact O-N 2.86Å
631	H	86.9	Confident	87.4	Confident	87 Å²	87	26.5 Å²	26.5	40%	0.403	13%	0.133	S	C	.	.	H	α-helix	trans	-58.1	-46.7	178.6	-78.5	89.1	0	0	0	111	D627 S628 F633 L634 D635	D627-H631 PolarHBondContact O-N 3.37Å; D627-H631 PolarHBondContact O-ND1 3.45Å; D627-H631 IonicContact OD1-CE1 2.71Å; D627-H631 PolarHBondContact OD1-CE1 3.3Å; D627-H631 IonicContact OD1-ND1 3.78Å; D627-H631 PolarHBondContact OD1-ND1 2.97Å; D627-H631 IonicContact OD2-CE1 2.77Å; D627-H631 PolarHBondContact OD2-CE1 3.39Å; D627-H631 VanDerWaalsContact OD2-CE1 3.26Å; D627-H631 IonicContact OD2-ND1 2.88Å; S628-H631 PolarHBondContact O-N 3.34Å; H631-F633 VanDerWaalsContact C-N 3.31Å; H631-F633 PolarHBondContact O-N 2.91Å; H631-L634 PolarHBondContact O-N 3.4Å; H631-L634 VanDerWaalsContact O-N 3.1Å; H631-D635 VanDerWaalsContact O-CG 3.3Å; H631-D635 PolarHBondContact O-N 2.83Å
632	R	88.7	Confident	87	Confident	48 Å²	48	29.1 Å²	29.1	18%	0.181	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-42.1	177.2	-178.1	57.2	177.7	147.9	-7.5	112.6	L541 H542 F547 S628 H629 R630 D635 L636	L541-R632 WeakPolarHBondContact O-CD 3.42Å; L541-R632 PolarHBondContact O-NE 3.24Å; H542-R632 PolarHBondContact O-NH2 3.14Å; F547-R632 HydrophobicContact CE1-CG 4.22Å; F547-R632 HydrophobicContact CZ-CG 3.97Å; S628-R632 WeakPolarHBondContact O-CB 3.39Å; S628-R632 PolarHBondContact O-N 3.23Å; H629-R632 PolarHBondContact O-N 3.21Å; R630-R632 VanDerWaalsContact C-N 3.33Å; R630-R632 PolarHBondContact O-N 3.21Å; R632-D635 PolarHBondContact O-N 3.19Å; R632-L636 HydrophobicContact CG-CD1 4.44Å; R632-L636 VanDerWaalsContact O-CG 3.28Å; R632-L636 WeakPolarHBondContact O-CG 3.36Å; R632-L636 PolarHBondContact O-N 2.9Å; R632-L636 VanDerWaalsContact O-N 3.08Å
633	F	92	Very high	85.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-44.6	174.8	174.5	-98.6	0	0	0	111.8	F547 V563 V565 I572 V599 V609 F624 H629 R630 H631 D635 L636 V637	F547-F633 HydrophobicContact CD2-CD2 4.25Å; F547-F633 HydrophobicContact CE2-CB 4.4Å; F547-F633 HydrophobicContact CE2-CD2 4.3Å; V563-F633 HydrophobicContact CG1-CD2 4.33Å; V563-F633 HydrophobicContact CG1-CE2 4.22Å; V563-F633 HydrophobicContact CG2-CD2 4.49Å; V563-F633 HydrophobicContact CG2-CE2 3.64Å; V563-F633 HydrophobicContact CG2-CZ 4.2Å; V565-F633 HydrophobicContact CG2-CD2 3.82Å; V565-F633 HydrophobicContact CG2-CE2 3.69Å; I572-F633 HydrophobicContact CD1-CE2 4.5Å; I572-F633 HydrophobicContact CD1-CZ 4.12Å; I572-F633 HydrophobicContact CG2-CE2 4.43Å; V599-F633 HydrophobicContact CG1-CE1 4.32Å; V609-F633 HydrophobicContact CG1-CD1 4.39Å; V609-F633 HydrophobicContact CG1-CE1 4.05Å; V609-F633 HydrophobicContact CG2-CD1 4.42Å; F624-F633 HydrophobicContact CD1-CB 4.43Å; F624-F633 HydrophobicContact CE1-CB 3.55Å; F624-F633 HydrophobicContact CE1-CD1 4.34Å; F624-F633 HydrophobicContact CE1-CD2 4.03Å; F624-F633 AromaticContact CE1-CG 3.72Å; F624-F633 HydrophobicContact CE1-CG 3.72Å; F624-F633 HydrophobicContact CE2-CB 4.41Å; F624-F633 AromaticContact CE2-CD1 3.98Å; F624-F633 HydrophobicContact CE2-CD1 3.98Å; F624-F633 HydrophobicContact CE2-CG 4.2Å; F624-F633 HydrophobicContact CZ-CB 3.56Å; F624-F633 AromaticContact CZ-CD1 3.47Å; F624-F633 HydrophobicContact CZ-CD1 3.47Å; F624-F633 VanDerWaalsContact CZ-CD1 3.47Å; F624-F633 AromaticContact CZ-CD2 3.73Å; F624-F633 HydrophobicContact CZ-CD2 3.73Å; F624-F633 HydrophobicContact CZ-CE1 4.04Å; F624-F633 HydrophobicContact CZ-CE2 4.28Å; F624-F633 AromaticContact CZ-CG 3.28Å; F624-F633 HydrophobicContact CZ-CG 3.28Å; F624-F633 HydrophobicContact CZ-CZ 4.41Å; H629-F633 WeakPolarHBondContact O-CB 3.07Å; H629-F633 PolarHBondContact O-N 3.13Å; R630-F633 PolarHBondContact O-N 3.43Å; H631-F633 VanDerWaalsContact C-N 3.31Å; H631-F633 PolarHBondContact O-N 2.91Å; F633-D635 VanDerWaalsContact C-N 3.35Å; F633-D635 PolarHBondContact O-N 3.03Å; F633-L636 PolarHBondContact O-N 3.35Å; F633-V637 HydrophobicContact CD1-CG2 4.14Å; F633-V637 HydrophobicContact CD2-CG2 4.48Å; F633-V637 HydrophobicContact CE1-CG2 3.7Å; F633-V637 HydrophobicContact CE2-CG2 4.07Å; F633-V637 HydrophobicContact CZ-CG2 3.66Å; F633-V637 WeakPolarHBondContact O-CG2 2.88Å; F633-V637 PolarHBondContact O-N 3.44Å
634	L	89.4	Confident	84.7	Confident	28 Å²	28	36.5 Å²	36.5	15%	0.147	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-41.9	177.2	-67.7	172.3	0	0	0	111.8	V599 A601 V609 R630 H631 L636 V637 D638	V599-L634 HydrophobicContact CG1-CD2 3.5Å; V599-L634 VanDerWaalsContact CG1-CD2 3.5Å; A601-L634 HydrophobicContact CB-CD1 4.09Å; V609-L634 HydrophobicContact CG1-CD2 4.19Å; V609-L634 HydrophobicContact CG2-CD2 4.24Å; V609-L634 HydrophobicContact CG2-CG 4.43Å; R630-L634 HydrophobicContact CG-CD1 3.98Å; R630-L634 HydrophobicContact CG-CG 4.43Å; R630-L634 WeakPolarHBondContact O-CG 2.98Å; R630-L634 PolarHBondContact O-N 2.86Å; H631-L634 PolarHBondContact O-N 3.4Å; H631-L634 VanDerWaalsContact O-N 3.1Å; L634-L636 VanDerWaalsContact C-N 3.33Å; L634-L636 PolarHBondContact O-N 3.29Å; L634-V637 PolarHBondContact O-N 3.4Å; L634-D638 PolarHBondContact O-N 3.13Å
635	D	87.6	Confident	83.1	Confident	95 Å²	95	44.7 Å²	44.7	51%	0.508	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-42	174.6	-64.6	-20	0	0	0	111.7	H631 R632 F633 D638 E639	H631-D635 VanDerWaalsContact O-CG 3.3Å; H631-D635 PolarHBondContact O-N 2.83Å; R632-D635 PolarHBondContact O-N 3.19Å; F633-D635 VanDerWaalsContact C-N 3.35Å; F633-D635 PolarHBondContact O-N 3.03Å; D635-D638 PolarHBondContact O-N 3.3Å; D635-E639 WeakPolarHBondContact O-CB 2.92Å; D635-E639 PolarHBondContact O-N 3.29Å
636	L	89.6	Confident	81.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-37.3	177.3	-71.5	171.2	0	0	0	112.1	L545 F547 V565 K567 R632 F633 L634 I640	L545-L636 HydrophobicContact CD2-CD1 4.07Å; L545-L636 HydrophobicContact CD2-CD2 3.79Å; F547-L636 HydrophobicContact CE2-CD1 3.81Å; F547-L636 HydrophobicContact CZ-CD1 3.8Å; V565-L636 HydrophobicContact CB-CB 4.16Å; V565-L636 HydrophobicContact CB-CD1 4.3Å; V565-L636 HydrophobicContact CG1-CB 4.07Å; V565-L636 HydrophobicContact CG2-CB 4.09Å; V565-L636 HydrophobicContact CG2-CD1 4.35Å; K567-L636 HydrophobicContact CD-CD2 4.49Å; R632-L636 HydrophobicContact CG-CD1 4.44Å; R632-L636 VanDerWaalsContact O-CG 3.28Å; R632-L636 WeakPolarHBondContact O-CG 3.36Å; R632-L636 PolarHBondContact O-N 2.9Å; R632-L636 VanDerWaalsContact O-N 3.08Å; F633-L636 PolarHBondContact O-N 3.35Å; L634-L636 VanDerWaalsContact C-N 3.33Å; L634-L636 PolarHBondContact O-N 3.29Å; L636-I640 PolarHBondContact O-N 2.79Å
637	V	88.1	Confident	80.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-44.4	174.7	172.6	0	0	0	0	110.8	I572 V599 F633 L634 E639 I640 T641 L649	I572-V637 HydrophobicContact CD1-CG2 3.77Å; V599-V637 HydrophobicContact CB-CG1 4.13Å; V599-V637 HydrophobicContact CG2-CG1 3.7Å; F633-V637 HydrophobicContact CD1-CG2 4.14Å; F633-V637 HydrophobicContact CD2-CG2 4.48Å; F633-V637 HydrophobicContact CE1-CG2 3.7Å; F633-V637 HydrophobicContact CE2-CG2 4.07Å; F633-V637 HydrophobicContact CZ-CG2 3.66Å; F633-V637 WeakPolarHBondContact O-CG2 2.88Å; F633-V637 PolarHBondContact O-N 3.44Å; L634-V637 PolarHBondContact O-N 3.4Å; V637-E639 VanDerWaalsContact C-N 3.28Å; V637-E639 PolarHBondContact O-N 2.93Å; V637-I640 VanDerWaalsContact O-CG1 3.28Å; V637-I640 WeakPolarHBondContact O-CG1 3.41Å; V637-I640 PolarHBondContact O-N 2.89Å; V637-T641 HydrophobicContact CG1-CG2 4.08Å; V637-T641 WeakPolarHBondContact O-CB 3.28Å; V637-T641 WeakPolarHBondContact O-CG2 3.5Å; V637-T641 PolarHBondContact O-N 3.42Å; V637-T641 PolarHBondContact O-OG1 2.75Å; V637-L649 HydrophobicContact CG1-CD2 4.49Å
638	D	85.2	Confident	79.5	Confident	84 Å²	84	50.7 Å²	50.7	45%	0.449	28%	0.278	S	S	.	.	H	α-helix	trans	-56.4	-46.1	175.8	-163.7	33.5	0	0	0	110.8	L634 D635 I640 T641 S642 L649	L634-D638 PolarHBondContact O-N 3.13Å; D635-D638 PolarHBondContact O-N 3.3Å; D638-I640 PolarHBondContact O-N 2.65Å; D638-T641 PolarHBondContact O-N 3.08Å; D638-T641 PolarHBondContact O-OG1 2.76Å; D638-S642 WeakPolarHBondContact O-CB 3.45Å; D638-S642 PolarHBondContact O-N 3.44Å; D638-L649 HydrophobicContact CB-CD1 3.61Å; D638-L649 VanDerWaalsContact CG-CD1 3.48Å; D638-L649 WeakPolarHBondContact OD1-CD1 3.34Å
639	E	86.4	Confident	78.2	Confident	97 Å²	97	52.5 Å²	52.5	45%	0.453	28%	0.284	S	S	.	.	H	α-helix	trans	-58.4	-47	178.8	-166.8	179	160	0	0	112.4	K567 D635 V637 S642	K567-E639 VanDerWaalsContact CE-OE2 3.32Å; K567-E639 WeakPolarHBondContact CE-OE2 3.34Å; K567-E639 IonicContact NZ-OE1 2.77Å; K567-E639 PolarHBondContact NZ-OE1 3Å; K567-E639 IonicContact NZ-OE2 3.21Å; K567-E639 PolarHBondContact NZ-OE2 3.3Å; D635-E639 WeakPolarHBondContact O-CB 2.92Å; D635-E639 PolarHBondContact O-N 3.29Å; V637-E639 VanDerWaalsContact C-N 3.28Å; V637-E639 PolarHBondContact O-N 2.93Å; E639-S642 PolarHBondContact O-OG 3.31Å
640	I	86.5	Confident	76.7	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-75.8	-24.1	-179.7	64.7	165	0	0	0	113.4	V565 K570 I572 I596 L636 V637 D638	V565-I640 HydrophobicContact CG1-CD1 3.98Å; V565-I640 HydrophobicContact CG1-CG1 4.49Å; V565-I640 HydrophobicContact CG1-CG2 3.99Å; K570-I640 HydrophobicContact CB-CB 4.25Å; K570-I640 HydrophobicContact CG-CB 4.43Å; I572-I640 HydrophobicContact CD1-CD1 4.29Å; I572-I640 HydrophobicContact CG1-CD1 3.8Å; I596-I640 HydrophobicContact CD1-CD1 4.24Å; L636-I640 PolarHBondContact O-N 2.79Å; V637-I640 VanDerWaalsContact O-CG1 3.28Å; V637-I640 WeakPolarHBondContact O-CG1 3.41Å; V637-I640 PolarHBondContact O-N 2.89Å; D638-I640 PolarHBondContact O-N 2.65Å
641	T	83.5	Confident	75	Confident	9 Å²	9	54.9 Å²	54.9	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-98.9	-13.4	-176.1	58.1	0	0	0	0	114.5	I596 V637 D638 N643 V644 T647	I596-T641 HydrophobicContact CD1-CG2 4.33Å; V637-T641 HydrophobicContact CG1-CG2 4.08Å; V637-T641 WeakPolarHBondContact O-CB 3.28Å; V637-T641 WeakPolarHBondContact O-CG2 3.5Å; V637-T641 PolarHBondContact O-N 3.42Å; V637-T641 PolarHBondContact O-OG1 2.75Å; D638-T641 PolarHBondContact O-N 3.08Å; D638-T641 PolarHBondContact O-OG1 2.76Å; T641-N643 PolarHBondContact O-N 2.72Å; T641-V644 PolarHBondContact O-N 2.87Å; T641-T647 HydrophobicContact CG2-CG2 3.48Å; T641-T647 VanDerWaalsContact CG2-CG2 3.48Å
642	S	78.7	Confident	73.1	Confident	78 Å²	78	56.3 Å²	56.3	55%	0.545	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-29.3	-179.3	56.2	0	0	0	0	115.9	D638 E639	D638-S642 WeakPolarHBondContact O-CB 3.45Å; D638-S642 PolarHBondContact O-N 3.44Å; E639-S642 PolarHBondContact O-OG 3.31Å
643	N	69.6	Low	71.4	Confident	128 Å²	128	55 Å²	55	68%	0.684	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	9	-178.9	-64.7	-13.3	0	0	0	114.2	T641	T641-N643 PolarHBondContact O-N 2.72Å
644	V	68.7	Low	69.2	Low	37 Å²	37	60.3 Å²	60.3	22%	0.224	35%	0.353	C	S	.	.			trans	-109.5	106.9	-176	-177.8	0	0	0	0	110.1	A593 T641 G646 T647	A593-V644 HydrophobicContact CB-CG2 3.87Å; T641-V644 PolarHBondContact O-N 2.87Å; V644-G646 PolarHBondContact O-N 3.37Å; V644-G646 VanDerWaalsContact O-N 3.14Å; V644-T647 PolarHBondContact O-N 2.75Å
645	D	57.2	Low	67	Low	172 Å²	172	67.6 Å²	67.6	92%	0.92	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	116.5	172.3	-76.2	-32.3	0	0	0	110.4
646	G	55.8	Low	65.3	Low	43 Å²	43	65.5 Å²	65.5	44%	0.443	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	115.1	-12.4	173.5	0	0	0	0	0	116.1	Y614 V644	Y614-G646 PolarHBondContact OH-O 3.46Å; V644-G646 PolarHBondContact O-N 3.37Å; V644-G646 VanDerWaalsContact O-N 3.14Å
647	T	54.8	Low	63.7	Low	21 Å²	21	74.3 Å²	74.3	13%	0.129	42%	0.421	C	S	.	.			trans	-85.3	119.5	170.3	-47.9	0	0	0	0	109.5	A593 I596 T641 V644	A593-T647 PolarHBondContact O-OG1 3.49Å; I596-T647 HydrophobicContact CB-CG2 4.03Å; I596-T647 HydrophobicContact CG2-CG2 3.66Å; I596-T647 PolarHBondContact O-OG1 3.23Å; T641-T647 HydrophobicContact CG2-CG2 3.48Å; T641-T647 VanDerWaalsContact CG2-CG2 3.48Å; V644-T647 PolarHBondContact O-N 2.75Å
648	K	60.9	Low	62.6	Low	82 Å²	82	80 Å²	80	36%	0.357	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.9	177	-67	-177.5	-179.2	178.2	0	110.6	R597 A598 V599 L650	R597-K648 PolarHBondContact O-N 3.45Å; R597-K648 VanDerWaalsContact O-N 3.14Å; A598-K648 WeakPolarHBondContact CA-O 3.46Å; A598-K648 WeakPolarHBondContact CB-O 2.97Å; V599-K648 PolarHBondContact N-O 3.46Å; K648-L650 HydrophobicContact CB-CD2 3.98Å; K648-L650 HydrophobicContact CB-CG 4.28Å; K648-L650 HydrophobicContact CD-CD2 4.33Å; K648-L650 PolarHBondContact O-N 2.92Å; K648-L650 VanDerWaalsContact O-N 3.13Å
649	L	55.5	Low	62.3	Low	73 Å²	73	77.2 Å²	77.2	38%	0.382	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	106.1	151.6	-77.7	174.2	0	0	0	106.9	V599 V637 D638 G651	V599-L649 HydrophobicContact CB-CD2 4.15Å; V637-L649 HydrophobicContact CG1-CD2 4.49Å; D638-L649 HydrophobicContact CB-CD1 3.61Å; D638-L649 VanDerWaalsContact CG-CD1 3.48Å; D638-L649 WeakPolarHBondContact OD1-CD1 3.34Å; L649-G651 PolarHBondContact O-N 3.05Å; L649-G651 VanDerWaalsContact O-N 3.1Å
650	L	57.4	Low	62.3	Low	13 Å²	13	75.9 Å²	75.9	7%	0.068	44%	0.437	C	S	.	.			trans	-78.7	101.4	179.6	-64.8	166.1	0	0	0	107.6	A598 V599 S600 Y612 K648 Y653 E712 L716	A598-L650 HydrophobicContact CB-CD1 3.54Å; A598-L650 HydrophobicContact CB-CG 3.89Å; V599-L650 PolarHBondContact O-N 2.84Å; V599-L650 VanDerWaalsContact O-N 3.09Å; S600-L650 PolarHBondContact OG-O 3.29Å; Y612-L650 HydrophobicContact CE2-CD1 4.37Å; K648-L650 HydrophobicContact CB-CD2 3.98Å; K648-L650 HydrophobicContact CB-CG 4.28Å; K648-L650 HydrophobicContact CD-CD2 4.33Å; K648-L650 PolarHBondContact O-N 2.92Å; K648-L650 VanDerWaalsContact O-N 3.13Å; L650-Y653 HydrophobicContact CB-CE2 4.48Å; L650-Y653 WeakPolarHBondContact CB-OH 3.15Å; L650-Y653 WeakPolarHBondContact CD1-OH 3.48Å; L650-E712 HydrophobicContact CD1-CB 4.07Å; L650-L716 HydrophobicContact CD1-CD1 4.04Å; L650-L716 HydrophobicContact CD1-CD2 4.06Å; L650-L716 HydrophobicContact CD1-CG 3.98Å; L650-L716 HydrophobicContact CD2-CD2 4.2Å
651	G	53	Low	62.5	Low	54 Å²	54	77.5 Å²	77.5	56%	0.557	44%	0.444	S	S	*	.			trans	-71	-167.9	173.5	0	0	0	0	0	113	L649 Y653	L649-G651 PolarHBondContact O-N 3.05Å; L649-G651 VanDerWaalsContact O-N 3.1Å; G651-Y653 PolarHBondContact O-N 3.47Å
652	D	46.9	Very low	62.9	Low	117 Å²	117	81.6 Å²	81.6	63%	0.626	46%	0.462	S	S	*	.			trans	-61.3	109.7	179.3	-87.4	-44.6	0	0	0	112.1	K603 S654	K603-D652 VanDerWaalsContact CE-OD1 3.23Å; K603-D652 WeakPolarHBondContact CE-OD1 3.42Å; K603-D652 IonicContact NZ-OD1 3.87Å; K603-D652 PolarHBondContact NZ-OD1 3.47Å; D652-S654 PolarHBondContact O-N 3.37Å
653	Y	52.9	Low	63.6	Low	21 Å²	21	80.3 Å²	80.3	8%	0.082	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-53.3	-6.4	174.1	-62.3	-94.7	0	0	0	115.8	L650 G651 E655 S656 E712 Q715	L650-Y653 HydrophobicContact CB-CE2 4.48Å; L650-Y653 WeakPolarHBondContact CB-OH 3.15Å; L650-Y653 WeakPolarHBondContact CD1-OH 3.48Å; G651-Y653 PolarHBondContact O-N 3.47Å; Y653-E655 PolarHBondContact O-N 2.99Å; Y653-S656 WeakPolarHBondContact O-CB 3.39Å; Y653-S656 PolarHBondContact O-N 3.26Å; Y653-S656 PolarHBondContact O-OG 3.49Å; Y653-E712 HydrophobicContact CE1-CB 4.23Å; Y653-E712 HydrophobicContact CE1-CG 4.17Å; Y653-E712 HydrophobicContact CE2-CG 3.78Å; Y653-E712 WeakPolarHBondContact CE2-OE1 3.2Å; Y653-E712 VanDerWaalsContact OH-CA 3.28Å; Y653-E712 WeakPolarHBondContact OH-CA 3.39Å; Y653-E712 WeakPolarHBondContact OH-CB 3.46Å; Y653-E712 WeakPolarHBondContact OH-CG 3.49Å; Y653-E712 PolarHBondContact OH-OE1 3.18Å; Y653-Q715 HydrophobicContact CE1-CB 4.02Å; Y653-Q715 HydrophobicContact CE1-CG 4.49Å
654	S	46.5	Very low	64.6	Low	110 Å²	110	77 Å²	77	77%	0.769	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-55.5	-16.8	176.9	-175.5	0	0	0	0	113.2	D652	D652-S654 PolarHBondContact O-N 3.37Å
655	E	43.1	Very low	65.7	Low	181 Å²	181	80.1 Å²	80.1	85%	0.846	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-91.9	-2.3	177.1	-66.1	-174.5	169.3	0	0	114.4	Y653 Q657	Y653-E655 PolarHBondContact O-N 2.99Å; E655-Q657 PolarHBondContact O-N 3.3Å
656	S	51.9	Low	67.1	Low	51 Å²	51	73.8 Å²	73.8	36%	0.357	41%	0.408	S	S	.	.	S	Bend	trans	-62.8	115.2	172.6	-52.8	0	0	0	0	108	Y653 T658	Y653-S656 WeakPolarHBondContact O-CB 3.39Å; Y653-S656 PolarHBondContact O-N 3.26Å; Y653-S656 PolarHBondContact O-OG 3.49Å; S656-T658 PolarHBondContact O-N 3.47Å
657	Q	54.1	Low	68.3	Low	185 Å²	185	76.4 Å²	76.4	86%	0.864	43%	0.426	S	S	*	.			trans	-48.5	110.5	178.1	-74.4	178.8	-7.6	0	0	109.4	E655 I659	E655-Q657 PolarHBondContact O-N 3.3Å; Q657-I659 PolarHBondContact O-N 3.47Å; Q657-I659 VanDerWaalsContact O-N 3.17Å
658	T	66.3	Low	69.7	Low	120 Å²	120	79.4 Å²	79.4	74%	0.736	45%	0.447	S	S	*	.			trans	-63.2	117	172.9	50.3	0	0	0	0	107.4	S656 D660	S656-T658 PolarHBondContact O-N 3.47Å; T658-D660 PolarHBondContact O-N 3.05Å
659	I	78.2	Confident	70.8	Confident	25 Å²	25	77.6 Å²	77.6	13%	0.128	45%	0.452	C	S	.	.			trans	-70.6	117.9	176.6	-64.5	172.4	0	0	0	106.9	Q657 F661 D687 I694 L729 F743	Q657-I659 PolarHBondContact O-N 3.47Å; Q657-I659 VanDerWaalsContact O-N 3.17Å; I659-F661 HydrophobicContact CG2-CB 4.34Å; I659-F661 WeakPolarHBondContact O-CD1 3.26Å; I659-F661 PolarHBondContact O-N 3.21Å; I659-D687 HydrophobicContact CG2-CB 4.07Å; I659-I694 HydrophobicContact CG2-CD1 4.43Å; I659-L729 HydrophobicContact CD1-CB 3.7Å; I659-F743 HydrophobicContact CB-CD2 4.39Å; I659-F743 HydrophobicContact CD1-CB 3.67Å; I659-F743 HydrophobicContact CD1-CD2 3.91Å; I659-F743 HydrophobicContact CD1-CG 3.88Å
660	D	86.3	Confident	72.3	Confident	70 Å²	70	80 Å²	80	37%	0.374	46%	0.461	S	S	.	.			trans	-74.6	115.4	169.2	-176.2	14.7	0	0	0	108.2	T658 D687 R688	T658-D660 PolarHBondContact O-N 3.05Å; D660-D687 CarbonylContact O-C 3.37Å; D660-R688 HydrophobicContact CB-CB 4.31Å; D660-R688 WeakPolarHBondContact O-CB 3.18Å; D660-R688 PolarHBondContact O-N 3.01Å; D660-R688 WeakPolarHBondContact OD1-CD 3.31Å; D660-R688 IonicContact OD1-CZ 2.73Å; D660-R688 IonicContact OD1-NH1 2.64Å; D660-R688 PolarHBondContact OD1-NH1 3.46Å; D660-R688 IonicContact OD2-CZ 3.05Å; D660-R688 IonicContact OD2-NE 3.76Å; D660-R688 IonicContact OD2-NH1 2.67Å; D660-R688 PolarHBondContact OD2-NH1 3.12Å
661	F	90.5	Very high	74	Confident	38 Å²	38	83.6 Å²	83.6	17%	0.167	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.3	-171.7	71.8	-84.8	0	0	0	112.9	I659 F663 R686 I694 I696 E732 F743	I659-F661 HydrophobicContact CG2-CB 4.34Å; I659-F661 WeakPolarHBondContact O-CD1 3.26Å; I659-F661 PolarHBondContact O-N 3.21Å; F661-F663 HydrophobicContact CE2-CD2 4.16Å; F661-F663 HydrophobicContact CE2-CE1 4.38Å; F661-F663 AromaticContact CE2-CE2 3.64Å; F661-F663 HydrophobicContact CE2-CE2 3.64Å; F661-F663 AromaticContact CE2-CZ 3.76Å; F661-F663 HydrophobicContact CE2-CZ 3.76Å; F661-F663 HydrophobicContact CZ-CE2 4.43Å; F661-R686 CarbonylContact C-O 3.59Å; F661-R686 VanDerWaalsContact CA-O 3.28Å; F661-R686 WeakPolarHBondContact CA-O 3.45Å; F661-I694 HydrophobicContact CB-CD1 3.96Å; F661-I696 HydrophobicContact CD2-CD1 3.41Å; F661-I696 VanDerWaalsContact CD2-CD1 3.41Å; F661-I696 HydrophobicContact CE2-CD1 3.83Å; F661-I696 HydrophobicContact CG-CD1 4.21Å; F661-E732 WeakPolarHBondContact CE1-OE2 3.36Å; F661-F743 HydrophobicContact CB-CE1 4.32Å; F661-F743 AromaticContact CD1-CE1 3.42Å; F661-F743 HydrophobicContact CD1-CE1 3.42Å; F661-F743 VanDerWaalsContact CD1-CE1 3.42Å; F661-F743 AromaticContact CD1-CZ 3.46Å; F661-F743 HydrophobicContact CD1-CZ 3.46Å; F661-F743 VanDerWaalsContact CD1-CZ 3.46Å; F661-F743 HydrophobicContact CD2-CE1 4.14Å; F661-F743 AromaticContact CE1-CE1 3.67Å; F661-F743 HydrophobicContact CE1-CE1 3.67Å; F661-F743 AromaticContact CE1-CZ 3.42Å; F661-F743 HydrophobicContact CE1-CZ 3.42Å; F661-F743 VanDerWaalsContact CE1-CZ 3.42Å; F661-F743 HydrophobicContact CE2-CE1 4.31Å; F661-F743 AromaticContact CG-CE1 3.69Å; F661-F743 HydrophobicContact CG-CE1 3.69Å; F661-F743 HydrophobicContact CG-CZ 4.22Å; F661-F743 HydrophobicContact CZ-CE1 4.1Å; F661-F743 HydrophobicContact CZ-CZ 4.11Å
662	E	92	Very high	75.7	Confident	94 Å²	94	81.9 Å²	81.9	44%	0.439	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	142.5	168.2	62.1	-176.1	-176.7	0	0	110.3	G685 R686 R688	E662-G685 CarbonylContact O-C 3.25Å; E662-G685 WeakPolarHBondContact O-CA 3.44Å; E662-R686 HydrophobicContact CG-CB 3.94Å; E662-R686 PolarHBondContact N-O 3.04Å; E662-R686 PolarHBondContact O-N 3.49Å; E662-R688 HydrophobicContact CB-CG 4.4Å; E662-R688 HydrophobicContact CG-CG 4.22Å
663	F	93.3	Very high	77.8	Confident	51 Å²	51	78.9 Å²	78.9	22%	0.224	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	139.3	172.6	-71.7	-77.7	0	0	0	110.1	F661 R671 Y683 I696 E698	F661-F663 HydrophobicContact CE2-CD2 4.16Å; F661-F663 HydrophobicContact CE2-CE1 4.38Å; F661-F663 AromaticContact CE2-CE2 3.64Å; F661-F663 HydrophobicContact CE2-CE2 3.64Å; F661-F663 AromaticContact CE2-CZ 3.76Å; F661-F663 HydrophobicContact CE2-CZ 3.76Å; F661-F663 HydrophobicContact CZ-CE2 4.43Å; F663-R671 HydrophobicContact CB-CG 4Å; F663-R671 HydrophobicContact CD1-CG 4.28Å; F663-R671 HydrophobicContact CG-CG 4.03Å; F663-Y683 HydrophobicContact CD1-CG 4.36Å; F663-Y683 HydrophobicContact CE1-CD2 4.17Å; F663-Y683 HydrophobicContact CE1-CG 4.16Å; F663-I696 HydrophobicContact CD1-CD1 3.94Å; F663-I696 HydrophobicContact CE1-CB 4.3Å; F663-I696 HydrophobicContact CE1-CD1 3.83Å; F663-I696 HydrophobicContact CE1-CG2 4.14Å; F663-I696 HydrophobicContact CZ-CD1 4.48Å; F663-E698 WeakPolarHBondContact CZ-OE1 3.43Å
664	E	92.1	Very high	79.4	Confident	59 Å²	59	81.5 Å²	81.5	28%	0.276	45%	0.454	S	S	.	.			trans	-72.7	129.9	166.9	-167.7	177.7	166.9	0	0	109	R671 V672 A684 H1163	E664-R671 WeakPolarHBondContact O-CA 3.48Å; E664-V672 HydrophobicContact CB-CB 4.4Å; E664-V672 HydrophobicContact CB-CG2 4.27Å; E664-V672 HydrophobicContact CG-CG2 4.03Å; E664-V672 PolarHBondContact O-N 3.5Å; E664-A684 HydrophobicContact CB-CB 4Å; E664-A684 PolarHBondContact N-O 3.44Å; E664-A684 WeakPolarHBondContact OE2-CB 3.45Å; E664-H1163 IonicContact OE1-CD2 3.85Å
665	L	90.8	Very high	81	Confident	102 Å²	102	77.8 Å²	77.8	53%	0.534	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-107	137	-179.9	-57.3	178.8	0	0	0	109.8	Q670 R671	L665-Q670 CarbonylContact C-O 3.49Å; L665-Q670 WeakPolarHBondContact CA-O 3.48Å; L665-R671 HydrophobicContact CD2-CG 4.12Å
666	D	87.3	Confident	82.7	Confident	40 Å²	40	77.5 Å²	77.5	21%	0.214	43%	0.428	C	S	.	.			trans	-75.4	175.7	170.2	69.8	21.7	0	0	0	111.5	S668 G669 Q670 V672 K1165	D666-S668 PolarHBondContact O-N 3.22Å; D666-S668 WeakPolarHBondContact OD1-CA 3.5Å; D666-S668 WeakPolarHBondContact OD1-CB 3.45Å; D666-S668 PolarHBondContact OD1-N 3.38Å; D666-S668 PolarHBondContact OD1-OG 3.33Å; D666-G669 PolarHBondContact O-N 3.5Å; D666-G669 PolarHBondContact OD1-N 2.86Å; D666-Q670 PolarHBondContact N-O 3.07Å; D666-Q670 PolarHBondContact OD1-N 3.5Å; D666-V672 HydrophobicContact CB-CG2 4.1Å; D666-K1165 IonicContact OD2-NZ 3.65Å; D666-K1165 PolarHBondContact OD2-NZ 2.92Å
667	A	81.5	Confident	83.5	Confident	98 Å²	98	77.6 Å²	77.6	81%	0.81	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.4	-178.9	0	0	0	0	0	114.3
668	S	84.3	Confident	83.9	Confident	84 Å²	84	74.8 Å²	74.8	59%	0.587	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	2.9	176	71.6	0	0	0	0	113.6	D666 Q670	D666-S668 PolarHBondContact O-N 3.22Å; D666-S668 WeakPolarHBondContact OD1-CA 3.5Å; D666-S668 WeakPolarHBondContact OD1-CB 3.45Å; D666-S668 PolarHBondContact OD1-N 3.38Å; D666-S668 PolarHBondContact OD1-OG 3.33Å; S668-Q670 VanDerWaalsContact C-N 3.28Å; S668-Q670 VanDerWaalsContact OG-CG 3.29Å; S668-Q670 WeakPolarHBondContact OG-CG 3.44Å
669	G	83.8	Confident	83.9	Confident	44 Å²	44	70.4 Å²	70.4	45%	0.454	40%	0.404	S	S	.	.	S	Bend	trans	74.8	15.7	-174.5	0	0	0	0	0	113.5	D666	D666-G669 PolarHBondContact O-N 3.5Å; D666-G669 PolarHBondContact OD1-N 2.86Å
670	Q	87	Confident	83.8	Confident	123 Å²	123	70.3 Å²	70.3	58%	0.575	41%	0.409	S	S	*	.			trans	-96.1	147.5	179.1	-63.2	-62.5	-37.4	0	0	111	L665 D666 S668 V672	L665-Q670 CarbonylContact C-O 3.49Å; L665-Q670 WeakPolarHBondContact CA-O 3.48Å; D666-Q670 PolarHBondContact N-O 3.07Å; D666-Q670 PolarHBondContact OD1-N 3.5Å; S668-Q670 VanDerWaalsContact C-N 3.28Å; S668-Q670 VanDerWaalsContact OG-CG 3.29Å; S668-Q670 WeakPolarHBondContact OG-CG 3.44Å; Q670-V672 PolarHBondContact O-N 3.41Å
671	R	92	Very high	83.9	Confident	89 Å²	89	67.7 Å²	67.7	34%	0.336	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-61.2	128.7	178.9	-61.6	-177.8	-70.8	172.7	3.3	110.9	F663 E664 L665 V673 Y683 E698	F663-R671 HydrophobicContact CB-CG 4Å; F663-R671 HydrophobicContact CD1-CG 4.28Å; F663-R671 HydrophobicContact CG-CG 4.03Å; E664-R671 WeakPolarHBondContact O-CA 3.48Å; L665-R671 HydrophobicContact CD2-CG 4.12Å; R671-V673 PolarHBondContact O-N 3.46Å; R671-Y683 HydrophobicContact CB-CD1 3.62Å; R671-Y683 HydrophobicContact CB-CE1 3.93Å; R671-Y683 HydrophobicContact CB-CG 4.48Å; R671-Y683 PolarHBondContact NH2-OH 3.31Å; R671-E698 IonicContact CZ-OE2 2.88Å; R671-E698 VanDerWaalsContact NH1-CD 3.28Å; R671-E698 IonicContact NH1-OE1 2.85Å; R671-E698 PolarHBondContact NH1-OE1 2.98Å; R671-E698 VanDerWaalsContact NH1-OE1 3.14Å; R671-E698 IonicContact NH1-OE2 3.89Å; R671-E698 PolarHBondContact NH1-OE2 3.11Å; R671-E698 IonicContact NH2-OE2 2.89Å
672	V	89.9	Confident	83.9	Confident	17 Å²	17	67.4 Å²	67.4	10%	0.103	40%	0.398	C	S	.	.			trans	-68	114.8	178.1	176.4	0	0	0	0	109.6	E664 D666 Q670 Y683 A684	E664-V672 HydrophobicContact CB-CB 4.4Å; E664-V672 HydrophobicContact CB-CG2 4.27Å; E664-V672 HydrophobicContact CG-CG2 4.03Å; E664-V672 PolarHBondContact O-N 3.5Å; D666-V672 HydrophobicContact CB-CG2 4.1Å; Q670-V672 PolarHBondContact O-N 3.41Å; V672-Y683 CarbonylContact O-C 3.46Å; V672-Y683 VanDerWaalsContact O-CA 3.24Å; V672-Y683 WeakPolarHBondContact O-CA 3.36Å; V672-A684 HydrophobicContact CB-CB 4.15Å; V672-A684 HydrophobicContact CG1-CB 4.1Å; V672-A684 PolarHBondContact O-N 3.11Å
673	V	89.6	Confident	84	Confident	55 Å²	55	64.5 Å²	64.5	33%	0.333	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.4	177.9	-179.4	0	0	0	0	109.4	R671 K676 V682 Y683	R671-V673 PolarHBondContact O-N 3.46Å; V673-K676 HydrophobicContact CG1-CG 4.02Å; V673-V682 CarbonylContact C-O 3.56Å; V673-Y683 HydrophobicContact CG2-CD1 3.93Å; V673-Y683 HydrophobicContact CG2-CE1 3.68Å
674	L	86	Confident	84	Confident	76 Å²	76	62 Å²	62	40%	0.398	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-33.5	173.2	-65	177.9	0	0	0	111.9	V682 A684 A695 Q746	L674-V682 HydrophobicContact CB-CB 4.42Å; L674-V682 HydrophobicContact CB-CG1 4.21Å; L674-V682 HydrophobicContact CD1-CG1 4.26Å; L674-V682 PolarHBondContact N-O 3.39Å; L674-A684 HydrophobicContact CD1-CB 4.08Å; L674-A684 HydrophobicContact CD2-CB 4.01Å; L674-A684 HydrophobicContact CG-CB 3.97Å; L674-A695 HydrophobicContact CD1-CB 3.93Å; L674-Q746 HydrophobicContact CD1-CG 4.09Å
675	G	81.8	Confident	84	Confident	31 Å²	31	59.3 Å²	59.3	32%	0.32	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	157.3	178.4	0	0	0	0	0	112.7	V682	G675-V682 PolarHBondContact N-O 3.06Å; G675-V682 PolarHBondContact O-N 3.49Å
676	K	78.9	Confident	84.1	Confident	175 Å²	175	59 Å²	59	76%	0.761	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.6	170.7	-65	-176.1	-179.3	-179.3	0	107.9	V673 A681	V673-K676 HydrophobicContact CG1-CG 4.02Å; K676-A681 HydrophobicContact CG-CB 4.42Å
677	G	67.5	Low	84.3	Confident	53 Å²	53	58.1 Å²	58.1	55%	0.546	35%	0.347	S	S	.	.			trans	-94.4	-177	175.3	0	0	0	0	0	112	F679 G680	G677-F679 VanDerWaalsContact C-N 3.28Å; G677-F679 PolarHBondContact O-N 3.1Å; G677-G680 PolarHBondContact N-O 3.14Å
678	T	62.9	Low	84.6	Confident	126 Å²	126	59.5 Å²	59.5	77%	0.773	33%	0.331	S	S	*	.	S	Bend	trans	-63.6	-32.7	175.6	47.1	0	0	0	0	113
679	F	65.2	Low	84.6	Confident	29 Å²	29	60.9 Å²	60.9	13%	0.127	34%	0.336	C	S	.	.	S	Bend	trans	-100.7	-12.1	-172.5	-52.1	-62.2	0	0	0	114.1	G677 V699 C816 L819 A820 T830	G677-F679 VanDerWaalsContact C-N 3.28Å; G677-F679 PolarHBondContact O-N 3.1Å; F679-V699 HydrophobicContact CB-CG2 4.44Å; F679-V699 WeakPolarHBondContact O-CG1 3.23Å; F679-C816 HydrophobicContact CE2-CB 4.04Å; F679-L819 HydrophobicContact CB-CB 4.1Å; F679-L819 HydrophobicContact CD1-CB 4.37Å; F679-L819 HydrophobicContact CD2-CB 4.01Å; F679-L819 HydrophobicContact CD2-CD1 4.32Å; F679-L819 HydrophobicContact CG-CB 3.89Å; F679-A820 HydrophobicContact CD1-CB 4.22Å; F679-A820 HydrophobicContact CE1-CB 3.49Å; F679-A820 VanDerWaalsContact CE1-CB 3.49Å; F679-A820 HydrophobicContact CZ-CB 4.08Å; F679-T830 HydrophobicContact CE1-CG2 4.14Å; F679-T830 HydrophobicContact CZ-CG2 4Å
680	G	77.5	Confident	84.6	Confident	23 Å²	23	61.2 Å²	61.2	24%	0.237	33%	0.331	C	S	.	.			trans	169.9	-173.2	-172	0	0	0	0	0	114.5	G677 E698	G677-G680 PolarHBondContact N-O 3.14Å; G680-E698 VanDerWaalsContact CA-O 3.24Å; G680-E698 WeakPolarHBondContact CA-O 3.23Å
681	A	87.6	Confident	84.6	Confident	14 Å²	14	60.3 Å²	60.3	12%	0.116	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.6	178.7	0	0	0	0	0	110.6	K676 Y683 E698	K676-A681 HydrophobicContact CG-CB 4.42Å; A681-Y683 HydrophobicContact CB-CE2 3.75Å; A681-E698 PolarHBondContact N-O 3.1Å; A681-E698 VanDerWaalsContact N-O 3.14Å; A681-E698 PolarHBondContact O-N 2.81Å
682	V	90.3	Very high	84.4	Confident	32 Å²	32	64.6 Å²	64.6	19%	0.194	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.4	174.6	-172.4	0	0	0	0	108.2	V673 L674 G675 A695 I696 K697	V673-V682 CarbonylContact C-O 3.56Å; L674-V682 HydrophobicContact CB-CB 4.42Å; L674-V682 HydrophobicContact CB-CG1 4.21Å; L674-V682 HydrophobicContact CD1-CG1 4.26Å; L674-V682 PolarHBondContact N-O 3.39Å; G675-V682 PolarHBondContact N-O 3.06Å; G675-V682 PolarHBondContact O-N 3.49Å; V682-A695 HydrophobicContact CG1-CB 3.98Å; V682-I696 CarbonylContact C-O 3.48Å; V682-I696 WeakPolarHBondContact CA-O 3.16Å; V682-K697 HydrophobicContact CG2-CB 4.09Å; V682-K697 HydrophobicContact CG2-CD 4.24Å; V682-K697 HydrophobicContact CG2-CG 3.97Å
683	Y	94	Very high	84.5	Confident	33 Å²	33	67.3 Å²	67.3	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	152.8	179	-57.5	-85	0	0	0	110.8	F663 R671 V672 V673 A681 A695 I696 E698	F663-Y683 HydrophobicContact CD1-CG 4.36Å; F663-Y683 HydrophobicContact CE1-CD2 4.17Å; F663-Y683 HydrophobicContact CE1-CG 4.16Å; R671-Y683 HydrophobicContact CB-CD1 3.62Å; R671-Y683 HydrophobicContact CB-CE1 3.93Å; R671-Y683 HydrophobicContact CB-CG 4.48Å; R671-Y683 PolarHBondContact NH2-OH 3.31Å; V672-Y683 CarbonylContact O-C 3.46Å; V672-Y683 VanDerWaalsContact O-CA 3.24Å; V672-Y683 WeakPolarHBondContact O-CA 3.36Å; V673-Y683 HydrophobicContact CG2-CD1 3.93Å; V673-Y683 HydrophobicContact CG2-CE1 3.68Å; A681-Y683 HydrophobicContact CB-CE2 3.75Å; Y683-A695 WeakPolarHBondContact O-CA 3.4Å; Y683-I696 PolarHBondContact N-O 3.48Å; Y683-I696 PolarHBondContact O-N 3.07Å; Y683-E698 HydrophobicContact CD2-CB 4.45Å; Y683-E698 HydrophobicContact CD2-CG 3.93Å; Y683-E698 HydrophobicContact CE2-CB 4Å; Y683-E698 HydrophobicContact CE2-CG 3.81Å; Y683-E698 WeakPolarHBondContact CE2-OE2 3.5Å
684	A	93.4	Very high	84.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.2	166.5	0	0	0	0	0	109.8	E664 V672 L674	E664-A684 HydrophobicContact CB-CB 4Å; E664-A684 PolarHBondContact N-O 3.44Å; E664-A684 WeakPolarHBondContact OE2-CB 3.45Å; V672-A684 HydrophobicContact CB-CB 4.15Å; V672-A684 HydrophobicContact CG1-CB 4.1Å; V672-A684 PolarHBondContact O-N 3.11Å; L674-A684 HydrophobicContact CD1-CB 4.08Å; L674-A684 HydrophobicContact CD2-CB 4.01Å; L674-A684 HydrophobicContact CG-CB 3.97Å
685	G	93.7	Very high	85	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	179.6	175.9	0	0	0	0	0	112	E662 T693 I694	E662-G685 CarbonylContact O-C 3.25Å; E662-G685 WeakPolarHBondContact O-CA 3.44Å; G685-T693 WeakPolarHBondContact O-CA 3.41Å; G685-I694 PolarHBondContact N-O 3.34Å; G685-I694 PolarHBondContact O-N 2.69Å
686	R	92.9	Very high	85.5	Confident	97 Å²	97	60 Å²	60	37%	0.366	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.1	177.4	-178.7	176.2	-72.6	-134.4	0.8	109.4	F661 E662 R688 R692	F661-R686 CarbonylContact C-O 3.59Å; F661-R686 VanDerWaalsContact CA-O 3.28Å; F661-R686 WeakPolarHBondContact CA-O 3.45Å; E662-R686 HydrophobicContact CG-CB 3.94Å; E662-R686 PolarHBondContact N-O 3.04Å; E662-R686 PolarHBondContact O-N 3.49Å; R686-R688 PolarHBondContact O-N 3.38Å; R686-R692 WeakPolarHBondContact CA-O 3.39Å
687	D	90.6	Very high	86	Confident	20 Å²	20	52.2 Å²	52.2	11%	0.107	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	118.1	167.4	171.2	5	0	0	0	108.2	I659 D660 T689 S690 Q691 R692 I694	I659-D687 HydrophobicContact CG2-CB 4.07Å; D660-D687 CarbonylContact O-C 3.37Å; D687-T689 PolarHBondContact O-N 3.08Å; D687-T689 WeakPolarHBondContact OD1-CA 3.19Å; D687-T689 VanDerWaalsContact OD1-CB 3.26Å; D687-T689 WeakPolarHBondContact OD1-CB 3.46Å; D687-T689 PolarHBondContact OD1-N 3.01Å; D687-T689 PolarHBondContact OD1-OG1 2.84Å; D687-S690 VanDerWaalsContact CG-OG 3.23Å; D687-S690 PolarHBondContact OD1-N 2.99Å; D687-S690 WeakPolarHBondContact OD2-CB 3.36Å; D687-S690 PolarHBondContact OD2-N 3.35Å; D687-S690 PolarHBondContact OD2-OG 2.58Å; D687-Q691 WeakPolarHBondContact O-CA 3.44Å; D687-Q691 PolarHBondContact O-N 2.89Å; D687-R692 PolarHBondContact N-O 2.84Å; D687-I694 HydrophobicContact CB-CD1 4.38Å; D687-I694 HydrophobicContact CB-CG2 4.14Å
688	R	87	Confident	87.1	Confident	128 Å²	128	50.7 Å²	50.7	48%	0.483	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.9	-178.3	-67.9	178.3	66.3	-136.4	-3.2	111.8	D660 E662 R686 Q691	D660-R688 HydrophobicContact CB-CB 4.31Å; D660-R688 WeakPolarHBondContact O-CB 3.18Å; D660-R688 PolarHBondContact O-N 3.01Å; D660-R688 WeakPolarHBondContact OD1-CD 3.31Å; D660-R688 IonicContact OD1-CZ 2.73Å; D660-R688 IonicContact OD1-NH1 2.64Å; D660-R688 PolarHBondContact OD1-NH1 3.46Å; D660-R688 IonicContact OD2-CZ 3.05Å; D660-R688 IonicContact OD2-NE 3.76Å; D660-R688 IonicContact OD2-NH1 2.67Å; D660-R688 PolarHBondContact OD2-NH1 3.12Å; E662-R688 HydrophobicContact CB-CG 4.4Å; E662-R688 HydrophobicContact CG-CG 4.22Å; R686-R688 PolarHBondContact O-N 3.38Å; R688-Q691 PolarHBondContact O-NE2 2.87Å
689	T	84.8	Confident	88.1	Confident	112 Å²	112	44.7 Å²	44.7	69%	0.687	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-51.4	-179.4	-47	0	0	0	0	111.3	D687	D687-T689 PolarHBondContact O-N 3.08Å; D687-T689 WeakPolarHBondContact OD1-CA 3.19Å; D687-T689 VanDerWaalsContact OD1-CB 3.26Å; D687-T689 WeakPolarHBondContact OD1-CB 3.46Å; D687-T689 PolarHBondContact OD1-N 3.01Å; D687-T689 PolarHBondContact OD1-OG1 2.84Å
690	S	84.9	Confident	88.9	Confident	51 Å²	51	49.1 Å²	49.1	36%	0.357	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-8.7	-178.1	72.3	0	0	0	0	114.7	D687 R692	D687-S690 VanDerWaalsContact CG-OG 3.23Å; D687-S690 PolarHBondContact OD1-N 2.99Å; D687-S690 WeakPolarHBondContact OD2-CB 3.36Å; D687-S690 PolarHBondContact OD2-N 3.35Å; D687-S690 PolarHBondContact OD2-OG 2.58Å; S690-R692 PolarHBondContact O-N 3.29Å; S690-R692 VanDerWaalsContact O-N 3.15Å; S690-R692 WeakPolarHBondContact OG-CB 3.37Å; S690-R692 WeakPolarHBondContact OG-CG 3.37Å; S690-R692 PolarHBondContact OG-N 3.22Å
691	Q	85.7	Confident	89.2	Confident	105 Å²	105	48.3 Å²	48.3	49%	0.491	23%	0.232	S	C	.	.			trans	56.4	20.1	-172.3	-66.8	-65.9	-48.2	0	0	113.9	D687 R688	D687-Q691 WeakPolarHBondContact O-CA 3.44Å; D687-Q691 PolarHBondContact O-N 2.89Å; R688-Q691 PolarHBondContact O-NE2 2.87Å
692	R	88.7	Confident	88.7	Confident	179 Å²	179	53.3 Å²	53.3	68%	0.675	25%	0.252	S	S	*	.			trans	-88.2	145.4	178.3	-64	177.7	-177.1	-173.5	1.7	110.7	R686 D687 S690	R686-R692 WeakPolarHBondContact CA-O 3.39Å; D687-R692 PolarHBondContact N-O 2.84Å; S690-R692 PolarHBondContact O-N 3.29Å; S690-R692 VanDerWaalsContact O-N 3.15Å; S690-R692 WeakPolarHBondContact OG-CB 3.37Å; S690-R692 WeakPolarHBondContact OG-CG 3.37Å; S690-R692 PolarHBondContact OG-N 3.22Å
693	T	91	Very high	87.9	Confident	73 Å²	73	53.1 Å²	53.1	45%	0.448	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	130.7	172.5	53.3	0	0	0	0	110.3	G685	G685-T693 WeakPolarHBondContact O-CA 3.41Å
694	I	93.5	Very high	87	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	153.3	-174.4	64.3	175.4	0	0	0	110.4	I659 F661 G685 D687 I696 L729 F743 M744	I659-I694 HydrophobicContact CG2-CD1 4.43Å; F661-I694 HydrophobicContact CB-CD1 3.96Å; G685-I694 PolarHBondContact N-O 3.34Å; G685-I694 PolarHBondContact O-N 2.69Å; D687-I694 HydrophobicContact CB-CD1 4.38Å; D687-I694 HydrophobicContact CB-CG2 4.14Å; I694-I696 HydrophobicContact CD1-CD1 4.27Å; I694-I696 HydrophobicContact CD1-CG1 4.1Å; I694-I696 HydrophobicContact CG1-CD1 4.43Å; I694-I696 HydrophobicContact CG1-CG1 4.1Å; I694-L729 HydrophobicContact CB-CD1 4.15Å; I694-L729 HydrophobicContact CG2-CD1 3.41Å; I694-L729 VanDerWaalsContact CG2-CD1 3.41Å; I694-F743 HydrophobicContact CD1-CD1 3.87Å; I694-M744 WeakPolarHBondContact CA-O 3.44Å
695	A	92.6	Very high	85.9	Confident	8 Å²	8	59.4 Å²	59.4	7%	0.066	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.8	168	0	0	0	0	0	109.3	L674 V682 Y683 M744 Q746	L674-A695 HydrophobicContact CD1-CB 3.93Å; V682-A695 HydrophobicContact CG1-CB 3.98Å; Y683-A695 WeakPolarHBondContact O-CA 3.4Å; A695-M744 HydrophobicContact CB-CG 3.81Å; A695-M744 PolarHBondContact N-O 2.79Å; A695-M744 PolarHBondContact O-N 3.38Å; A695-Q746 HydrophobicContact CB-CB 4.47Å
696	I	92.7	Very high	84.9	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	105.9	-175.8	-50.9	174.2	0	0	0	108.2	F661 F663 V682 Y683 I694 E698 R741 I742 F743	F661-I696 HydrophobicContact CD2-CD1 3.41Å; F661-I696 VanDerWaalsContact CD2-CD1 3.41Å; F661-I696 HydrophobicContact CE2-CD1 3.83Å; F661-I696 HydrophobicContact CG-CD1 4.21Å; F663-I696 HydrophobicContact CD1-CD1 3.94Å; F663-I696 HydrophobicContact CE1-CB 4.3Å; F663-I696 HydrophobicContact CE1-CD1 3.83Å; F663-I696 HydrophobicContact CE1-CG2 4.14Å; F663-I696 HydrophobicContact CZ-CD1 4.48Å; V682-I696 CarbonylContact C-O 3.48Å; V682-I696 WeakPolarHBondContact CA-O 3.16Å; Y683-I696 PolarHBondContact N-O 3.48Å; Y683-I696 PolarHBondContact O-N 3.07Å; I694-I696 HydrophobicContact CD1-CD1 4.27Å; I694-I696 HydrophobicContact CD1-CG1 4.1Å; I694-I696 HydrophobicContact CG1-CD1 4.43Å; I694-I696 HydrophobicContact CG1-CG1 4.1Å; I696-E698 HydrophobicContact CG2-CG 4.49Å; I696-R741 HydrophobicContact CG2-CB 4.39Å; I696-I742 WeakPolarHBondContact CA-O 3.3Å; I696-F743 HydrophobicContact CD1-CE1 4.34Å; I696-F743 HydrophobicContact CG1-CD1 4Å; I696-F743 HydrophobicContact CG1-CE1 4.18Å; I696-F743 HydrophobicContact CG2-CD1 4.28Å; I696-F743 HydrophobicContact CG2-CE1 4.02Å
697	K	89.5	Confident	84	Confident	11 Å²	11	57.2 Å²	57.2	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.3	175.9	-174.4	168.4	-179.6	175.1	0	109.3	V682 V699 R741 I742 D812	V682-K697 HydrophobicContact CG2-CB 4.09Å; V682-K697 HydrophobicContact CG2-CD 4.24Å; V682-K697 HydrophobicContact CG2-CG 3.97Å; K697-V699 HydrophobicContact CG-CG2 4.4Å; K697-R741 CarbonylContact O-C 3.52Å; K697-R741 WeakPolarHBondContact O-CA 3.35Å; K697-I742 HydrophobicContact CB-CB 4.25Å; K697-I742 PolarHBondContact N-O 2.78Å; K697-I742 PolarHBondContact O-N 2.88Å; K697-D812 IonicContact NZ-OD1 3.88Å; K697-D812 PolarHBondContact NZ-OD1 3.37Å; K697-D812 IonicContact NZ-OD2 2.7Å; K697-D812 PolarHBondContact NZ-OD2 3.11Å
698	E	90.2	Very high	83.2	Confident	22 Å²	22	57.1 Å²	57.1	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.7	174.2	-65	-165.3	145.6	0	0	110.7	F663 R671 G680 A681 Y683 I696 V739 F740 R741	F663-E698 WeakPolarHBondContact CZ-OE1 3.43Å; R671-E698 IonicContact CZ-OE2 2.88Å; R671-E698 VanDerWaalsContact NH1-CD 3.28Å; R671-E698 IonicContact NH1-OE1 2.85Å; R671-E698 PolarHBondContact NH1-OE1 2.98Å; R671-E698 VanDerWaalsContact NH1-OE1 3.14Å; R671-E698 IonicContact NH1-OE2 3.89Å; R671-E698 PolarHBondContact NH1-OE2 3.11Å; R671-E698 IonicContact NH2-OE2 2.89Å; G680-E698 VanDerWaalsContact CA-O 3.24Å; G680-E698 WeakPolarHBondContact CA-O 3.23Å; A681-E698 PolarHBondContact N-O 3.1Å; A681-E698 VanDerWaalsContact N-O 3.14Å; A681-E698 PolarHBondContact O-N 2.81Å; Y683-E698 HydrophobicContact CD2-CB 4.45Å; Y683-E698 HydrophobicContact CD2-CG 3.93Å; Y683-E698 HydrophobicContact CE2-CB 4Å; Y683-E698 HydrophobicContact CE2-CG 3.81Å; Y683-E698 WeakPolarHBondContact CE2-OE2 3.5Å; I696-E698 HydrophobicContact CG2-CG 4.49Å; E698-V739 HydrophobicContact CB-CG1 3.77Å; E698-V739 HydrophobicContact CG-CG1 3.94Å; E698-F740 WeakPolarHBondContact CA-O 3.36Å; E698-R741 HydrophobicContact CG-CG 4.3Å; E698-R741 IonicContact OE1-NE 3.72Å; E698-R741 PolarHBondContact OE1-NE 3.45Å
699	V	84.3	Confident	82.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130	175.5	173.6	0	0	0	0	108.4	F679 K697 I701 F740 L819 L822	F679-V699 HydrophobicContact CB-CG2 4.44Å; F679-V699 WeakPolarHBondContact O-CG1 3.23Å; K697-V699 HydrophobicContact CG-CG2 4.4Å; V699-I701 PolarHBondContact O-N 2.9Å; V699-F740 HydrophobicContact CB-CB 4.39Å; V699-F740 PolarHBondContact N-O 3Å; V699-F740 PolarHBondContact O-N 2.94Å; V699-L819 HydrophobicContact CB-CD2 4.31Å; V699-L819 HydrophobicContact CG1-CD2 4.28Å; V699-L819 HydrophobicContact CG2-CD2 3.65Å; V699-L822 HydrophobicContact CG1-CB 4.15Å; V699-L822 HydrophobicContact CG1-CD1 3.93Å
700	Q	82.1	Confident	81.7	Confident	121 Å²	121	45.8 Å²	45.8	57%	0.565	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.2	175.4	-70.1	-179.1	-6.8	0	0	110.2	K702 N823	Q700-K702 PolarHBondContact O-N 2.81Å; Q700-N823 WeakPolarHBondContact O-CB 3.39Å
701	I	83.7	Confident	81.1	Confident	6 Å²	6	45 Å²	45	3%	0.031	21%	0.21	C	C	.	.			trans	-87.9	105.3	177.6	-57.2	167.4	0	0	0	108	V699 H704 V707 V733 N737 Q738 F740 L822	V699-I701 PolarHBondContact O-N 2.9Å; I701-H704 HydrophobicContact CG2-CB 4Å; I701-H704 VanDerWaalsContact CG2-CG 3.44Å; I701-H704 WeakPolarHBondContact CG2-ND1 3.33Å; I701-V707 HydrophobicContact CD1-CG2 4.01Å; I701-V707 HydrophobicContact CG1-CG2 4.22Å; I701-V707 HydrophobicContact CG2-CG2 3.74Å; I701-V733 HydrophobicContact CD1-CG1 3.81Å; I701-N737 WeakPolarHBondContact CD1-O 3.4Å; I701-Q738 PolarHBondContact N-O 3.07Å; I701-F740 HydrophobicContact CD1-CB 3.94Å; I701-F740 HydrophobicContact CG1-CB 3.82Å; I701-L822 HydrophobicContact CG1-CD2 4.5Å; I701-L822 HydrophobicContact CG2-CD2 4.27Å
702	K	77.9	Confident	80.4	Confident	120 Å²	120	40 Å²	40	52%	0.522	19%	0.186	S	C	.	.	S	Bend	trans	-97.8	-35.6	168.3	-63.5	-164.1	-175.3	168.4	0	112.1	Q700 L822 N823	Q700-K702 PolarHBondContact O-N 2.81Å; K702-L822 CarbonylContact C-O 3.59Å; K702-L822 WeakPolarHBondContact CA-O 3.28Å; K702-L822 WeakPolarHBondContact CB-O 3.41Å; K702-L822 PolarHBondContact N-O 2.78Å; K702-N823 WeakPolarHBondContact CD-OD1 3.28Å; K702-N823 WeakPolarHBondContact CE-OD1 3.2Å; K702-N823 WeakPolarHBondContact CG-OD1 3.41Å; K702-N823 PolarHBondContact NZ-OD1 2.89Å
703	N	73.2	Confident	79.5	Confident	27 Å²	27	32.4 Å²	32.4	14%	0.144	16%	0.159	C	C	.	.			trans	-115.6	96.4	176	-179	13.6	0	0	0	109.4	K556 E705 E706 G821 L822	K556-N703 PolarHBondContact NZ-ND2 3.22Å; N703-E705 PolarHBondContact O-N 3.46Å; N703-E705 VanDerWaalsContact O-N 3.17Å; N703-E705 WeakPolarHBondContact OD1-CB 3.38Å; N703-E705 WeakPolarHBondContact OD1-CG 3.46Å; N703-E705 PolarHBondContact OD1-N 3.44Å; N703-E706 WeakPolarHBondContact ND2-CG 3.33Å; N703-E706 PolarHBondContact O-N 3.14Å; N703-G821 VanDerWaalsContact CB-O 3.28Å; N703-G821 WeakPolarHBondContact CB-O 3.49Å; N703-G821 PolarHBondContact ND2-O 3.41Å; N703-L822 PolarHBondContact N-O 3.15Å
704	H	75.7	Confident	78.5	Confident	59 Å²	59	29 Å²	29	27%	0.273	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-68.9	-12	-178.6	-60.6	-106.7	0	0	0	113.6	R604 I701 E706 V707 N737	R604-H704 VanDerWaalsContact CZ-CB 3.5Å; R604-H704 PolarHBondContact NE-O 2.77Å; R604-H704 VanDerWaalsContact NH1-C 3.3Å; R604-H704 PolarHBondContact NH2-O 3.47Å; R604-H704 VanDerWaalsContact NH2-O 3.12Å; I701-H704 HydrophobicContact CG2-CB 4Å; I701-H704 VanDerWaalsContact CG2-CG 3.44Å; I701-H704 WeakPolarHBondContact CG2-ND1 3.33Å; H704-E706 PolarHBondContact O-N 3.31Å; H704-V707 HydrophobicContact CB-CG2 4.4Å; H704-V707 PolarHBondContact O-N 2.97Å; H704-N737 PolarHBondContact CE1-O 3.46Å; H704-N737 PolarHBondContact ND1-O 2.86Å
705	E	69.2	Low	77.3	Confident	107 Å²	107	31.9 Å²	31.9	50%	0.5	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-64	-26.1	179.2	-62.1	179.9	162.7	0	0	112.3	R604 N703 P709	R604-E705 VanDerWaalsContact NH1-CG 3.32Å; R604-E705 VanDerWaalsContact NH1-N 3.17Å; N703-E705 PolarHBondContact O-N 3.46Å; N703-E705 VanDerWaalsContact O-N 3.17Å; N703-E705 WeakPolarHBondContact OD1-CB 3.38Å; N703-E705 WeakPolarHBondContact OD1-CG 3.46Å; N703-E705 PolarHBondContact OD1-N 3.44Å; E705-P709 WeakPolarHBondContact O-CD 3.48Å
706	E	72.3	Confident	76	Confident	35 Å²	35	32.2 Å²	32.2	16%	0.164	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-91.8	-4.9	-176.7	-56.7	-68	156.6	0	0	113	N703 H704 L710 L822	N703-E706 WeakPolarHBondContact ND2-CG 3.33Å; N703-E706 PolarHBondContact O-N 3.14Å; H704-E706 PolarHBondContact O-N 3.31Å; E706-L710 VanDerWaalsContact O-CB 3.27Å; E706-L710 WeakPolarHBondContact O-CB 3.32Å; E706-L710 PolarHBondContact O-N 2.94Å; E706-L710 VanDerWaalsContact O-N 3.09Å; E706-L822 HydrophobicContact CB-CD2 4.07Å; E706-L822 HydrophobicContact CB-CG 4.48Å
707	V	75.3	Confident	74.7	Confident	16 Å²	16	32.4 Å²	32.4	10%	0.097	15%	0.152	C	C	.	.	H	α-helix	trans	-65.9	-53.4	-177.9	174.9	0	0	0	0	111.4	I701 H704 L710 M711 V733 F740 L822	I701-V707 HydrophobicContact CD1-CG2 4.01Å; I701-V707 HydrophobicContact CG1-CG2 4.22Å; I701-V707 HydrophobicContact CG2-CG2 3.74Å; H704-V707 HydrophobicContact CB-CG2 4.4Å; H704-V707 PolarHBondContact O-N 2.97Å; V707-L710 PolarHBondContact O-N 3.26Å; V707-M711 HydrophobicContact CG1-CG 4.41Å; V707-M711 HydrophobicContact CG1-SD 4.04Å; V707-M711 WeakPolarHBondContact O-CG 3.39Å; V707-M711 PolarHBondContact O-N 2.81Å; V707-V733 HydrophobicContact CG1-CG2 3.61Å; V707-F740 HydrophobicContact CG1-CD2 3.99Å; V707-F740 HydrophobicContact CG1-CE2 3.95Å; V707-L822 HydrophobicContact CB-CD2 4.17Å; V707-L822 HydrophobicContact CG2-CD2 3.32Å
708	Q	72.8	Confident	73.6	Confident	19 Å²	19	33.7 Å²	33.7	9%	0.089	16%	0.163	C	C	.	.	H	α-helix	trans	-56.7	-58.2	-179.7	166.4	-178.8	10.1	0	0	109.8	A601 Y610 L710 M711 E712	A601-Q708 PolarHBondContact O-NE2 2.93Å; Y610-Q708 HydrophobicContact CE2-CG 4.37Å; Q708-L710 PolarHBondContact O-N 3.4Å; Q708-L710 VanDerWaalsContact O-N 3.13Å; Q708-M711 WeakPolarHBondContact O-CB 3.47Å; Q708-M711 PolarHBondContact O-N 3.24Å; Q708-E712 HydrophobicContact CG-CG 3.97Å; Q708-E712 WeakPolarHBondContact CG-OE1 3.27Å; Q708-E712 PolarHBondContact NE2-OE1 3.17Å; Q708-E712 WeakPolarHBondContact O-CG 3.38Å; Q708-E712 PolarHBondContact O-N 3.02Å
709	P	68.4	Low	72.5	Confident	2 Å²	2	37 Å²	37	1%	0.013	18%	0.184	C	C	.	.	H	α-helix	trans	-52.1	-39.7	178.9	-24.2	31.5	0	0	0	113.6	Y610 E705 E712 E713 R818	Y610-P709 HydrophobicContact CE1-CB 4.5Å; Y610-P709 HydrophobicContact CE1-CG 3.74Å; Y610-P709 HydrophobicContact CE2-CG 4.15Å; Y610-P709 WeakPolarHBondContact OH-CG 3.44Å; E705-P709 WeakPolarHBondContact O-CD 3.48Å; P709-E712 PolarHBondContact O-N 3.46Å; P709-E713 WeakPolarHBondContact O-CB 3.36Å; P709-E713 PolarHBondContact O-N 2.85Å; P709-R818 PolarHBondContact O-NH1 3.41Å
710	L	71.4	Confident	72.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-43.7	176.2	178.2	67	0	0	0	112.6	E706 V707 Q708 E712 E713 I714 F740 T815 R818 L819 L822	E706-L710 VanDerWaalsContact O-CB 3.27Å; E706-L710 WeakPolarHBondContact O-CB 3.32Å; E706-L710 PolarHBondContact O-N 2.94Å; E706-L710 VanDerWaalsContact O-N 3.09Å; V707-L710 PolarHBondContact O-N 3.26Å; Q708-L710 PolarHBondContact O-N 3.4Å; Q708-L710 VanDerWaalsContact O-N 3.13Å; L710-E712 VanDerWaalsContact C-N 3.34Å; L710-E713 PolarHBondContact O-N 3.49Å; L710-I714 HydrophobicContact CD1-CD1 4.13Å; L710-I714 HydrophobicContact CD1-CG1 4.45Å; L710-I714 HydrophobicContact CG-CD1 3.94Å; L710-I714 VanDerWaalsContact O-CG1 3.26Å; L710-I714 WeakPolarHBondContact O-CG1 3.37Å; L710-I714 PolarHBondContact O-N 3.32Å; L710-F740 HydrophobicContact CD2-CD1 3.55Å; L710-F740 HydrophobicContact CD2-CE1 3.26Å; L710-F740 HydrophobicContact CD2-CE2 4.37Å; L710-F740 HydrophobicContact CD2-CG 4.2Å; L710-F740 HydrophobicContact CD2-CZ 3.73Å; L710-F740 HydrophobicContact CG-CE1 3.8Å; L710-F740 HydrophobicContact CG-CZ 3.96Å; L710-T815 HydrophobicContact CD1-CG2 4.36Å; L710-R818 HydrophobicContact CB-CB 4.17Å; L710-R818 HydrophobicContact CD1-CB 3.74Å; L710-R818 HydrophobicContact CG-CB 4.5Å; L710-L819 HydrophobicContact CD1-CD2 4.32Å; L710-L819 HydrophobicContact CD1-CG 4.27Å; L710-L819 HydrophobicContact CD2-CD2 3.72Å; L710-L819 HydrophobicContact CD2-CG 4.47Å; L710-L822 HydrophobicContact CD2-CD1 3.33Å; L710-L822 HydrophobicContact CD2-CG 4.06Å
711	M	72.8	Confident	72	Confident	35 Å²	35	34.5 Å²	34.5	17%	0.172	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-43.3	176	-67.7	179.9	73.1	0	0	111.6	V707 Q708 E713 I714 Q715 V733 F740	V707-M711 HydrophobicContact CG1-CG 4.41Å; V707-M711 HydrophobicContact CG1-SD 4.04Å; V707-M711 WeakPolarHBondContact O-CG 3.39Å; V707-M711 PolarHBondContact O-N 2.81Å; Q708-M711 WeakPolarHBondContact O-CB 3.47Å; Q708-M711 PolarHBondContact O-N 3.24Å; M711-E713 VanDerWaalsContact C-N 3.33Å; M711-E713 PolarHBondContact O-N 3.44Å; M711-I714 PolarHBondContact O-N 3.3Å; M711-Q715 PolarHBondContact O-N 3.42Å; M711-V733 HydrophobicContact SD-CG2 4.23Å; M711-F740 HydrophobicContact CG-CE2 3.4Å; M711-F740 HydrophobicContact CG-CZ 3.58Å; M711-F740 HydrophobicContact SD-CE2 4.08Å
712	E	71.1	Confident	72.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-45.9	178.6	-41.8	-148.5	144.7	0	0	110.5	S600 Y612 L650 Y653 Q708 P709 L710 I714 Q715 L716	S600-E712 VanDerWaalsContact CB-OE2 3.32Å; S600-E712 WeakPolarHBondContact CB-OE2 3.24Å; S600-E712 PolarHBondContact OG-OE1 2.82Å; Y612-E712 HydrophobicContact CE2-CB 4.39Å; Y612-E712 WeakPolarHBondContact CE2-OE2 3.45Å; Y612-E712 PolarHBondContact OH-OE2 2.82Å; L650-E712 HydrophobicContact CD1-CB 4.07Å; Y653-E712 HydrophobicContact CE1-CB 4.23Å; Y653-E712 HydrophobicContact CE1-CG 4.17Å; Y653-E712 HydrophobicContact CE2-CG 3.78Å; Y653-E712 WeakPolarHBondContact CE2-OE1 3.2Å; Y653-E712 VanDerWaalsContact OH-CA 3.28Å; Y653-E712 WeakPolarHBondContact OH-CA 3.39Å; Y653-E712 WeakPolarHBondContact OH-CB 3.46Å; Y653-E712 WeakPolarHBondContact OH-CG 3.49Å; Y653-E712 PolarHBondContact OH-OE1 3.18Å; Q708-E712 HydrophobicContact CG-CG 3.97Å; Q708-E712 WeakPolarHBondContact CG-OE1 3.27Å; Q708-E712 PolarHBondContact NE2-OE1 3.17Å; Q708-E712 WeakPolarHBondContact O-CG 3.38Å; Q708-E712 PolarHBondContact O-N 3.02Å; P709-E712 PolarHBondContact O-N 3.46Å; L710-E712 VanDerWaalsContact C-N 3.34Å; E712-I714 PolarHBondContact O-N 2.65Å; E712-Q715 PolarHBondContact O-N 2.94Å; E712-L716 WeakPolarHBondContact O-CB 3.31Å; E712-L716 VanDerWaalsContact O-CG 3.23Å; E712-L716 WeakPolarHBondContact O-CG 2.98Å; E712-L716 PolarHBondContact O-N 2.86Å
713	E	69.9	Low	73	Confident	19 Å²	19	34.9 Å²	34.9	9%	0.089	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-41.7	176.8	-173.8	175.8	-179.1	0	0	112.1	P709 L710 M711 L716 H717 R818	P709-E713 WeakPolarHBondContact O-CB 3.36Å; P709-E713 PolarHBondContact O-N 2.85Å; L710-E713 PolarHBondContact O-N 3.49Å; M711-E713 VanDerWaalsContact C-N 3.33Å; M711-E713 PolarHBondContact O-N 3.44Å; E713-L716 PolarHBondContact O-N 3.17Å; E713-H717 PolarHBondContact O-N 3.12Å; E713-H717 VanDerWaalsContact O-N 3.08Å; E713-H717 PolarHBondContact O-ND1 3.37Å; E713-H717 IonicContact OE1-CE1 3.36Å; E713-R818 WeakPolarHBondContact OE2-CD 3.24Å; E713-R818 WeakPolarHBondContact OE2-CG 3.23Å
714	I	69.9	Low	74	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-43.4	175.5	-69.3	165.5	0	0	0	110.7	L710 M711 E712 L716 H717 S718 C731 F740 I742 T815	L710-I714 HydrophobicContact CD1-CD1 4.13Å; L710-I714 HydrophobicContact CD1-CG1 4.45Å; L710-I714 HydrophobicContact CG-CD1 3.94Å; L710-I714 VanDerWaalsContact O-CG1 3.26Å; L710-I714 WeakPolarHBondContact O-CG1 3.37Å; L710-I714 PolarHBondContact O-N 3.32Å; M711-I714 PolarHBondContact O-N 3.3Å; E712-I714 PolarHBondContact O-N 2.65Å; I714-L716 VanDerWaalsContact C-N 3.33Å; I714-L716 PolarHBondContact O-N 3.26Å; I714-H717 CarbonylContact O-C 3.58Å; I714-H717 PolarHBondContact O-N 2.83Å; I714-S718 PolarHBondContact O-N 3.32Å; I714-C731 HydrophobicContact CD1-CB 4.12Å; I714-C731 HydrophobicContact CG2-CB 4.29Å; I714-F740 HydrophobicContact CD1-CE1 3.65Å; I714-F740 HydrophobicContact CD1-CZ 3.89Å; I714-I742 HydrophobicContact CD1-CD1 3.72Å; I714-I742 HydrophobicContact CD1-CG1 3.86Å; I714-I742 HydrophobicContact CD1-CG2 4.39Å; I714-T815 HydrophobicContact CG1-CG2 4.05Å
715	Q	68.8	Low	74.7	Confident	61 Å²	61	31 Å²	31	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-65.6	-36.4	176.7	-179.4	171.2	-4.9	0	0	112.1	Y653 M711 E712 H717 S718	Y653-Q715 HydrophobicContact CE1-CB 4.02Å; Y653-Q715 HydrophobicContact CE1-CG 4.49Å; M711-Q715 PolarHBondContact O-N 3.42Å; E712-Q715 PolarHBondContact O-N 2.94Å; Q715-H717 PolarHBondContact O-N 3.15Å; Q715-S718 PolarHBondContact O-N 3.03Å; Q715-S718 PolarHBondContact O-OG 3.46Å
716	L	65.3	Low	75.6	Confident	14 Å²	14	26 Å²	26	7%	0.073	15%	0.151	C	C	.	.	H	α-helix	trans	-69.3	-16.2	173.9	-68.4	169.8	0	0	0	112.8	R597 A598 Y612 L650 E712 E713 I714	R597-L716 HydrophobicContact CG-CD1 4.26Å; R597-L716 HydrophobicContact CG-CD2 4.22Å; R597-L716 VanDerWaalsContact CZ-CB 3.49Å; R597-L716 PolarHBondContact NH2-O 2.97Å; A598-L716 HydrophobicContact CB-CD1 4.12Å; A598-L716 HydrophobicContact CB-CD2 3.9Å; Y612-L716 HydrophobicContact CD1-CD1 4.49Å; Y612-L716 HydrophobicContact CG-CD1 4.3Å; L650-L716 HydrophobicContact CD1-CD1 4.04Å; L650-L716 HydrophobicContact CD1-CD2 4.06Å; L650-L716 HydrophobicContact CD1-CG 3.98Å; L650-L716 HydrophobicContact CD2-CD2 4.2Å; E712-L716 WeakPolarHBondContact O-CB 3.31Å; E712-L716 VanDerWaalsContact O-CG 3.23Å; E712-L716 WeakPolarHBondContact O-CG 2.98Å; E712-L716 PolarHBondContact O-N 2.86Å; E713-L716 PolarHBondContact O-N 3.17Å; I714-L716 VanDerWaalsContact C-N 3.33Å; I714-L716 PolarHBondContact O-N 3.26Å
717	H	65.9	Low	76.3	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.019	16%	0.155	C	C	.	.	H	α-helix	trans	-101.1	-19.7	175	-70.5	150.9	0	0	0	113.8	R597 E713 I714 Q715 T719 L720 F813	R597-H717 PolarHBondContact NH2-CD2 3.03Å; R597-H717 PolarHBondContact NH2-NE2 3.18Å; E713-H717 PolarHBondContact O-N 3.12Å; E713-H717 VanDerWaalsContact O-N 3.08Å; E713-H717 PolarHBondContact O-ND1 3.37Å; E713-H717 IonicContact OE1-CE1 3.36Å; I714-H717 CarbonylContact O-C 3.58Å; I714-H717 PolarHBondContact O-N 2.83Å; Q715-H717 PolarHBondContact O-N 3.15Å; H717-T719 PolarHBondContact O-N 2.94Å; H717-T719 VanDerWaalsContact O-N 3.14Å; H717-L720 HydrophobicContact CB-CD1 4.04Å; H717-L720 VanDerWaalsContact O-CB 3.28Å; H717-L720 WeakPolarHBondContact O-CB 3.39Å; H717-L720 WeakPolarHBondContact O-CD1 3.25Å; H717-L720 VanDerWaalsContact O-CG 3.29Å; H717-L720 WeakPolarHBondContact O-CG 3.27Å; H717-L720 PolarHBondContact O-N 2.78Å; H717-F813 HydrophobicContact CB-CE2 3.76Å; H717-F813 HydrophobicContact CB-CZ 4.35Å; H717-F813 AromaticContact CD2-CE2 3.92Å; H717-F813 AromaticContact CG-CE2 3.57Å; H717-F813 AromaticContact ND1-CE2 3.87Å
718	S	66.3	Low	76.7	Confident	39 Å²	39	26.5 Å²	26.5	27%	0.273	15%	0.152	S	C	.	.	H	α-helix	trans	-64.2	-20.5	-177.8	67.2	0	0	0	0	113.1	I714 Q715 L720 Q727	I714-S718 PolarHBondContact O-N 3.32Å; Q715-S718 PolarHBondContact O-N 3.03Å; Q715-S718 PolarHBondContact O-OG 3.46Å; S718-L720 VanDerWaalsContact C-N 3.26Å; S718-L720 PolarHBondContact O-N 3.45Å; S718-Q727 PolarHBondContact O-NE2 3.28Å; S718-Q727 VanDerWaalsContact O-NE2 3.09Å
719	T	67.3	Low	77.3	Confident	90 Å²	90	29 Å²	29	55%	0.552	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.2	174.3	57.4	0	0	0	0	114.1	H717 A721	H717-T719 PolarHBondContact O-N 2.94Å; H717-T719 VanDerWaalsContact O-N 3.14Å; T719-A721 PolarHBondContact O-N 3.37Å
720	L	74.6	Confident	77.9	Confident	7 Å²	7	29.8 Å²	29.8	4%	0.037	17%	0.174	C	C	.	.			trans	-77.8	121.8	178.3	-60.2	166.3	0	0	0	109.6	H717 S718 Q727 Y783 L784 Q787 I789 F813	H717-L720 HydrophobicContact CB-CD1 4.04Å; H717-L720 VanDerWaalsContact O-CB 3.28Å; H717-L720 WeakPolarHBondContact O-CB 3.39Å; H717-L720 WeakPolarHBondContact O-CD1 3.25Å; H717-L720 VanDerWaalsContact O-CG 3.29Å; H717-L720 WeakPolarHBondContact O-CG 3.27Å; H717-L720 PolarHBondContact O-N 2.78Å; S718-L720 VanDerWaalsContact C-N 3.26Å; S718-L720 PolarHBondContact O-N 3.45Å; L720-Q727 PolarHBondContact O-NE2 2.91Å; L720-Q727 PolarHBondContact O-OE1 3.07Å; L720-Q727 VanDerWaalsContact O-OE1 3.12Å; L720-Y783 HydrophobicContact CB-CE1 4.19Å; L720-Y783 HydrophobicContact CD2-CE1 3.81Å; L720-L784 HydrophobicContact CD1-CD2 4.18Å; L720-Q787 HydrophobicContact CD2-CB 4.02Å; L720-Q787 HydrophobicContact CD2-CG 3.81Å; L720-I789 HydrophobicContact CD1-CD1 3.34Å; L720-I789 HydrophobicContact CD2-CD1 3.62Å; L720-I789 HydrophobicContact CG-CD1 4.03Å; L720-F813 HydrophobicContact CD1-CD2 4.4Å; L720-F813 HydrophobicContact CD1-CE2 3.36Å; L720-F813 HydrophobicContact CD1-CZ 3.65Å
721	A	80.6	Confident	78.5	Confident	63 Å²	63	31 Å²	31	52%	0.521	18%	0.183	S	C	.	.			trans	-130.9	110.6	177	0	0	0	0	0	109	T719 Y783	T719-A721 PolarHBondContact O-N 3.37Å; A721-Y783 PolarHBondContact N-OH 3.08Å; A721-Y783 PolarHBondContact O-OH 3.4Å
722	H	90.1	Very high	79	Confident	51 Å²	51	31.2 Å²	31.2	24%	0.236	18%	0.183	C	C	.	.			trans	-150.1	144.3	178	-172.9	-98.7	0	0	0	110.6	N724 I725 Y783	H722-N724 PolarHBondContact CE1-OD1 3.1Å; H722-N724 VanDerWaalsContact CE1-OD1 3.3Å; H722-N724 PolarHBondContact ND1-N 3.3Å; H722-N724 VanDerWaalsContact ND1-N 3.11Å; H722-N724 PolarHBondContact O-N 3.09Å; H722-N724 VanDerWaalsContact O-N 3.1Å; H722-I725 HydrophobicContact CB-CB 4.1Å; H722-I725 HydrophobicContact CB-CD1 3.82Å; H722-I725 HydrophobicContact CB-CG1 3.97Å; H722-I725 PolarHBondContact O-N 3.34Å; H722-Y783 HydrophobicContact CB-CD1 3.83Å; H722-Y783 HydrophobicContact CB-CD2 4.26Å; H722-Y783 HydrophobicContact CB-CE1 3.94Å; H722-Y783 HydrophobicContact CB-CE2 4.39Å; H722-Y783 HydrophobicContact CB-CG 3.95Å; H722-Y783 AromaticContact CD2-CD2 3.73Å; H722-Y783 AromaticContact CD2-CG 3.77Å; H722-Y783 AromaticContact CG-CG 3.86Å
723	T	91.7	Very high	79.7	Confident	82 Å²	82	32.8 Å²	32.8	50%	0.503	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.4	-177	-53	0	0	0	0	113.2	L807 K809	T723-L807 HydrophobicContact CG2-CD1 4.16Å; T723-L807 HydrophobicContact CG2-CD2 4.16Å; T723-K809 VanDerWaalsContact O-CE 3.23Å; T723-K809 WeakPolarHBondContact O-CE 3.25Å; T723-K809 WeakPolarHBondContact O-CG 3.37Å
724	N	94	Very high	80.3	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.021	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	18.2	-179.8	-52.2	103.7	0	0	0	114.3	H722 Q776 C808 K809 I810	H722-N724 PolarHBondContact CE1-OD1 3.1Å; H722-N724 VanDerWaalsContact CE1-OD1 3.3Å; H722-N724 PolarHBondContact ND1-N 3.3Å; H722-N724 VanDerWaalsContact ND1-N 3.11Å; H722-N724 PolarHBondContact O-N 3.09Å; H722-N724 VanDerWaalsContact O-N 3.1Å; N724-Q776 VanDerWaalsContact CB-O 3.26Å; N724-Q776 WeakPolarHBondContact CB-O 3.48Å; N724-Q776 WeakPolarHBondContact ND2-CB 3.14Å; N724-Q776 PolarHBondContact ND2-OE1 2.89Å; N724-Q776 VanDerWaalsContact ND2-OE1 3.08Å; N724-C808 WeakPolarHBondContact CA-O 3.39Å; N724-C808 WeakPolarHBondContact CB-O 3.38Å; N724-C808 PolarHBondContact ND2-O 3.47Å; N724-K809 WeakPolarHBondContact O-CA 3.44Å; N724-I810 PolarHBondContact O-N 2.85Å
725	I	90.5	Very high	80.7	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-126.8	136.7	174.4	-61	176.3	0	0	0	107.7	H722 Q727 Y783 L784 F813	H722-I725 HydrophobicContact CB-CB 4.1Å; H722-I725 HydrophobicContact CB-CD1 3.82Å; H722-I725 HydrophobicContact CB-CG1 3.97Å; H722-I725 PolarHBondContact O-N 3.34Å; I725-Q727 PolarHBondContact O-N 3.41Å; I725-Y783 HydrophobicContact CD1-CD1 3.27Å; I725-Y783 HydrophobicContact CD1-CE1 3.84Å; I725-Y783 HydrophobicContact CD1-CG 4.21Å; I725-L784 HydrophobicContact CD1-CD1 4.4Å; I725-L784 HydrophobicContact CD1-CD2 3.65Å; I725-L784 HydrophobicContact CD1-CG 3.64Å; I725-F813 HydrophobicContact CG2-CD1 4.27Å; I725-F813 HydrophobicContact CG2-CE1 3.41Å; I725-F813 VanDerWaalsContact CG2-CE1 3.41Å; I725-F813 HydrophobicContact CG2-CZ 3.89Å
726	V	89.7	Confident	81.3	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.012	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-71.3	125.7	176.1	173.9	0	0	0	0	110.1	Y728 M744 E745 V747 K809 I810 V811	V726-Y728 PolarHBondContact O-N 3.34Å; V726-M744 HydrophobicContact CB-CE 4.31Å; V726-M744 HydrophobicContact CG1-CB 4.13Å; V726-M744 HydrophobicContact CG1-CE 3.51Å; V726-E745 WeakPolarHBondContact CA-OE1 3.18Å; V726-E745 HydrophobicContact CG1-CG 3.66Å; V726-V747 HydrophobicContact CG2-CG2 3.74Å; V726-K809 HydrophobicContact CG2-CB 3.4Å; V726-K809 VanDerWaalsContact CG2-CB 3.4Å; V726-K809 HydrophobicContact CG2-CD 4.08Å; V726-K809 HydrophobicContact CG2-CG 4.38Å; V726-I810 PolarHBondContact N-O 3.23Å; V726-V811 HydrophobicContact CB-CG1 3.68Å; V726-V811 HydrophobicContact CG1-CG1 4.14Å; V726-V811 HydrophobicContact CG2-CG1 3.23Å
727	Q	86.7	Confident	82	Confident	53 Å²	53	45.2 Å²	45.2	25%	0.248	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-69.1	118	178.2	-174	63.6	54.1	0	0	110.7	S718 L720 I725 L729 M744 E745	S718-Q727 PolarHBondContact O-NE2 3.28Å; S718-Q727 VanDerWaalsContact O-NE2 3.09Å; L720-Q727 PolarHBondContact O-NE2 2.91Å; L720-Q727 PolarHBondContact O-OE1 3.07Å; L720-Q727 VanDerWaalsContact O-OE1 3.12Å; I725-Q727 PolarHBondContact O-N 3.41Å; Q727-L729 HydrophobicContact CG-CD2 4.06Å; Q727-M744 WeakPolarHBondContact O-CA 3.4Å; Q727-E745 HydrophobicContact CB-CB 4.37Å; Q727-E745 HydrophobicContact CB-CG 4.01Å; Q727-E745 PolarHBondContact N-OE1 3.27Å; Q727-E745 PolarHBondContact O-N 3.44Å
728	Y	84	Confident	82.9	Confident	7 Å²	7	49.8 Å²	49.8	3%	0.027	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.9	165	-74.3	-79.6	0	0	0	109.4	V726 I742 M744 F813	V726-Y728 PolarHBondContact O-N 3.34Å; Y728-I742 HydrophobicContact CD1-CG2 3.77Å; Y728-I742 HydrophobicContact CE1-CG2 3.78Å; Y728-M744 HydrophobicContact CD1-CB 4.44Å; Y728-M744 HydrophobicContact CE1-CE 4.39Å; Y728-F813 HydrophobicContact CD2-CE1 4.15Å; Y728-F813 AromaticContact CD2-CZ 3.75Å; Y728-F813 HydrophobicContact CD2-CZ 3.75Å; Y728-F813 HydrophobicContact CE2-CD1 4.24Å; Y728-F813 AromaticContact CE2-CE1 3.48Å; Y728-F813 HydrophobicContact CE2-CE1 3.48Å; Y728-F813 VanDerWaalsContact CE2-CE1 3.48Å; Y728-F813 HydrophobicContact CE2-CE2 4.05Å; Y728-F813 AromaticContact CE2-CZ 3.39Å; Y728-F813 HydrophobicContact CE2-CZ 3.39Å
729	L	83.7	Confident	83.8	Confident	71 Å²	71	49.3 Å²	49.3	37%	0.372	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-33.4	-178.3	-57.6	176	0	0	0	111.5	I659 I694 Q727 F743	I659-L729 HydrophobicContact CD1-CB 3.7Å; I694-L729 HydrophobicContact CB-CD1 4.15Å; I694-L729 HydrophobicContact CG2-CD1 3.41Å; I694-L729 VanDerWaalsContact CG2-CD1 3.41Å; Q727-L729 HydrophobicContact CG-CD2 4.06Å; L729-F743 HydrophobicContact CB-CB 4.08Å; L729-F743 PolarHBondContact N-O 3.08Å
730	G	81.4	Confident	84.7	Confident	19 Å²	19	45 Å²	45	20%	0.196	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-174.7	178.7	0	0	0	0	0	113.1	F743	G730-F743 PolarHBondContact N-O 3.09Å; G730-F743 PolarHBondContact O-N 3.22Å
731	C	84.1	Confident	85.4	Confident	27 Å²	27	46.7 Å²	46.7	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	157.5	171.8	63.3	0	0	0	0	110.9	I714 F740 R741	I714-C731 HydrophobicContact CD1-CB 4.12Å; I714-C731 HydrophobicContact CG2-CB 4.29Å; C731-F740 HydrophobicContact CB-CE1 4.26Å; C731-F740 HydrophobicContact CB-CZ 3.89Å; C731-R741 CarbonylContact C-O 3.6Å; C731-R741 WeakPolarHBondContact CA-O 3.28Å; C731-R741 WeakPolarHBondContact CB-O 3.3Å
732	E	84.5	Confident	85.7	Confident	39 Å²	39	43.8 Å²	43.8	18%	0.182	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	149.8	-179.4	-176.3	-158.7	122.5	0	0	109.6	F661 R741 F743	F661-E732 WeakPolarHBondContact CE1-OE2 3.36Å; E732-R741 PolarHBondContact N-O 3.27Å; E732-R741 PolarHBondContact O-N 3.22Å; E732-R741 IonicContact OE1-NH1 3.91Å; E732-R741 PolarHBondContact OE1-NH1 3.49Å; E732-F743 HydrophobicContact CB-CE2 3.75Å; E732-F743 HydrophobicContact CB-CZ 4.25Å
733	V	84.4	Confident	85.7	Confident	32 Å²	32	41.4 Å²	41.4	19%	0.194	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.1	166.5	178.7	0	0	0	0	107.5	I701 V707 M711 N737 F740	I701-V733 HydrophobicContact CD1-CG1 3.81Å; V707-V733 HydrophobicContact CG1-CG2 3.61Å; M711-V733 HydrophobicContact SD-CG2 4.23Å; V733-N737 HydrophobicContact CG1-CB 4.25Å; V733-N737 WeakPolarHBondContact CG1-OD1 3.4Å; V733-F740 HydrophobicContact CG2-CD2 3.8Å; V733-F740 HydrophobicContact CG2-CE2 4.06Å
734	S	83.9	Confident	85.6	Confident	5 Å²	5	38.1 Å²	38.1	4%	0.035	20%	0.202	C	C	.	.			trans	-57.1	154	177	56.7	0	0	0	0	112.4	D736 N737 Q738 V739	S734-D736 VanDerWaalsContact CB-OD1 3.26Å; S734-D736 WeakPolarHBondContact CB-OD1 3.35Å; S734-D736 PolarHBondContact O-N 3.11Å; S734-D736 VanDerWaalsContact O-N 3.1Å; S734-D736 PolarHBondContact OG-OD1 3.13Å; S734-N737 VanDerWaalsContact O-CA 3.31Å; S734-N737 WeakPolarHBondContact O-CA 3.48Å; S734-N737 PolarHBondContact O-N 3.49Å; S734-Q738 PolarHBondContact OG-N 3.17Å; S734-V739 PolarHBondContact N-O 3.35Å; S734-V739 PolarHBondContact OG-N 3.25Å; S734-V739 PolarHBondContact OG-O 3.03Å
735	D	77.6	Confident	85.4	Confident	164 Å²	164	40.2 Å²	40.2	88%	0.877	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.4	-178.1	-63.7	-36.8	0	0	0	114	N737	D735-N737 PolarHBondContact O-N 3.39Å
736	D	81.6	Confident	85.4	Confident	100 Å²	100	41.7 Å²	41.7	54%	0.535	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.3	176.1	66.8	-5.4	0	0	0	113.8	S734 Q738	S734-D736 VanDerWaalsContact CB-OD1 3.26Å; S734-D736 WeakPolarHBondContact CB-OD1 3.35Å; S734-D736 PolarHBondContact O-N 3.11Å; S734-D736 VanDerWaalsContact O-N 3.1Å; S734-D736 PolarHBondContact OG-OD1 3.13Å; D736-Q738 HydrophobicContact CB-CG 4.21Å; D736-Q738 PolarHBondContact O-N 3.41Å; D736-Q738 PolarHBondContact O-NE2 3.49Å; D736-Q738 PolarHBondContact OD1-N 3.43Å
737	N	78.9	Confident	85.5	Confident	89 Å²	89	42.4 Å²	42.4	48%	0.476	22%	0.223	S	C	.	.	S	Bend	trans	57.3	15.8	-173.6	-63.8	-69.7	0	0	0	115.3	I701 H704 V733 S734 D735	I701-N737 WeakPolarHBondContact CD1-O 3.4Å; H704-N737 PolarHBondContact CE1-O 3.46Å; H704-N737 PolarHBondContact ND1-O 2.86Å; V733-N737 HydrophobicContact CG1-CB 4.25Å; V733-N737 WeakPolarHBondContact CG1-OD1 3.4Å; S734-N737 VanDerWaalsContact O-CA 3.31Å; S734-N737 WeakPolarHBondContact O-CA 3.48Å; S734-N737 PolarHBondContact O-N 3.49Å; D735-N737 PolarHBondContact O-N 3.39Å
738	Q	84.6	Confident	85.4	Confident	99 Å²	99	42.2 Å²	42.2	46%	0.463	23%	0.226	S	C	.	.			trans	-90.3	-22.6	-176	-62.8	-56.2	-57.1	0	0	114.1	I701 S734 D736	I701-Q738 PolarHBondContact N-O 3.07Å; S734-Q738 PolarHBondContact OG-N 3.17Å; D736-Q738 HydrophobicContact CB-CG 4.21Å; D736-Q738 PolarHBondContact O-N 3.41Å; D736-Q738 PolarHBondContact O-NE2 3.49Å; D736-Q738 PolarHBondContact OD1-N 3.43Å
739	V	86.6	Confident	85.4	Confident	29 Å²	29	43.6 Å²	43.6	18%	0.176	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.8	-172	-177.3	0	0	0	0	110.3	E698 S734 R741	E698-V739 HydrophobicContact CB-CG1 3.77Å; E698-V739 HydrophobicContact CG-CG1 3.94Å; S734-V739 PolarHBondContact N-O 3.35Å; S734-V739 PolarHBondContact OG-N 3.25Å; S734-V739 PolarHBondContact OG-O 3.03Å; V739-R741 HydrophobicContact CG1-CG 4.14Å
740	F	86.7	Confident	85.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.9	170	-166.9	-99.9	0	0	0	109.4	E698 V699 I701 V707 L710 M711 I714 C731 V733 I742 L822	E698-F740 WeakPolarHBondContact CA-O 3.36Å; V699-F740 HydrophobicContact CB-CB 4.39Å; V699-F740 PolarHBondContact N-O 3Å; V699-F740 PolarHBondContact O-N 2.94Å; I701-F740 HydrophobicContact CD1-CB 3.94Å; I701-F740 HydrophobicContact CG1-CB 3.82Å; V707-F740 HydrophobicContact CG1-CD2 3.99Å; V707-F740 HydrophobicContact CG1-CE2 3.95Å; L710-F740 HydrophobicContact CD2-CD1 3.55Å; L710-F740 HydrophobicContact CD2-CE1 3.26Å; L710-F740 HydrophobicContact CD2-CE2 4.37Å; L710-F740 HydrophobicContact CD2-CG 4.2Å; L710-F740 HydrophobicContact CD2-CZ 3.73Å; L710-F740 HydrophobicContact CG-CE1 3.8Å; L710-F740 HydrophobicContact CG-CZ 3.96Å; M711-F740 HydrophobicContact CG-CE2 3.4Å; M711-F740 HydrophobicContact CG-CZ 3.58Å; M711-F740 HydrophobicContact SD-CE2 4.08Å; I714-F740 HydrophobicContact CD1-CE1 3.65Å; I714-F740 HydrophobicContact CD1-CZ 3.89Å; C731-F740 HydrophobicContact CB-CE1 4.26Å; C731-F740 HydrophobicContact CB-CZ 3.89Å; V733-F740 HydrophobicContact CG2-CD2 3.8Å; V733-F740 HydrophobicContact CG2-CE2 4.06Å; F740-I742 HydrophobicContact CD1-CD1 4.15Å; F740-I742 HydrophobicContact CD1-CG1 3.77Å; F740-I742 HydrophobicContact CE1-CD1 3.86Å; F740-I742 HydrophobicContact CE1-CG1 3.49Å; F740-I742 VanDerWaalsContact CE1-CG1 3.49Å; F740-L822 HydrophobicContact CB-CD1 3.87Å; F740-L822 HydrophobicContact CD1-CD1 4.16Å; F740-L822 HydrophobicContact CG-CD1 3.93Å
741	R	88.7	Confident	86.1	Confident	42 Å²	42	40.9 Å²	40.9	16%	0.158	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.2	-179.5	-58.1	-169.7	-178	109.8	1.8	110.4	I696 K697 E698 C731 E732 V739 F743	I696-R741 HydrophobicContact CG2-CB 4.39Å; K697-R741 CarbonylContact O-C 3.52Å; K697-R741 WeakPolarHBondContact O-CA 3.35Å; E698-R741 HydrophobicContact CG-CG 4.3Å; E698-R741 IonicContact OE1-NE 3.72Å; E698-R741 PolarHBondContact OE1-NE 3.45Å; C731-R741 CarbonylContact C-O 3.6Å; C731-R741 WeakPolarHBondContact CA-O 3.28Å; C731-R741 WeakPolarHBondContact CB-O 3.3Å; E732-R741 PolarHBondContact N-O 3.27Å; E732-R741 PolarHBondContact O-N 3.22Å; E732-R741 IonicContact OE1-NH1 3.91Å; E732-R741 PolarHBondContact OE1-NH1 3.49Å; V739-R741 HydrophobicContact CG1-CG 4.14Å; R741-F743 HydrophobicContact CB-CE2 4.42Å; R741-F743 HydrophobicContact CB-CZ 4.13Å
742	I	87	Confident	86.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.2	172.7	-52.7	174.3	0	0	0	108.1	I696 K697 I714 Y728 F740 L819	I696-I742 WeakPolarHBondContact CA-O 3.3Å; K697-I742 HydrophobicContact CB-CB 4.25Å; K697-I742 PolarHBondContact N-O 2.78Å; K697-I742 PolarHBondContact O-N 2.88Å; I714-I742 HydrophobicContact CD1-CD1 3.72Å; I714-I742 HydrophobicContact CD1-CG1 3.86Å; I714-I742 HydrophobicContact CD1-CG2 4.39Å; Y728-I742 HydrophobicContact CD1-CG2 3.77Å; Y728-I742 HydrophobicContact CE1-CG2 3.78Å; F740-I742 HydrophobicContact CD1-CD1 4.15Å; F740-I742 HydrophobicContact CD1-CG1 3.77Å; F740-I742 HydrophobicContact CE1-CD1 3.86Å; F740-I742 HydrophobicContact CE1-CG1 3.49Å; F740-I742 VanDerWaalsContact CE1-CG1 3.49Å; I742-L819 HydrophobicContact CD1-CD2 4.11Å
743	F	88.9	Confident	86.7	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.8	178	-53.8	-75.9	0	0	0	109.7	I659 F661 I694 I696 L729 G730 E732 R741	I659-F743 HydrophobicContact CB-CD2 4.39Å; I659-F743 HydrophobicContact CD1-CB 3.67Å; I659-F743 HydrophobicContact CD1-CD2 3.91Å; I659-F743 HydrophobicContact CD1-CG 3.88Å; F661-F743 HydrophobicContact CB-CE1 4.32Å; F661-F743 AromaticContact CD1-CE1 3.42Å; F661-F743 HydrophobicContact CD1-CE1 3.42Å; F661-F743 VanDerWaalsContact CD1-CE1 3.42Å; F661-F743 AromaticContact CD1-CZ 3.46Å; F661-F743 HydrophobicContact CD1-CZ 3.46Å; F661-F743 VanDerWaalsContact CD1-CZ 3.46Å; F661-F743 HydrophobicContact CD2-CE1 4.14Å; F661-F743 AromaticContact CE1-CE1 3.67Å; F661-F743 HydrophobicContact CE1-CE1 3.67Å; F661-F743 AromaticContact CE1-CZ 3.42Å; F661-F743 HydrophobicContact CE1-CZ 3.42Å; F661-F743 VanDerWaalsContact CE1-CZ 3.42Å; F661-F743 HydrophobicContact CE2-CE1 4.31Å; F661-F743 AromaticContact CG-CE1 3.69Å; F661-F743 HydrophobicContact CG-CE1 3.69Å; F661-F743 HydrophobicContact CG-CZ 4.22Å; F661-F743 HydrophobicContact CZ-CE1 4.1Å; F661-F743 HydrophobicContact CZ-CZ 4.11Å; I694-F743 HydrophobicContact CD1-CD1 3.87Å; I696-F743 HydrophobicContact CD1-CE1 4.34Å; I696-F743 HydrophobicContact CG1-CD1 4Å; I696-F743 HydrophobicContact CG1-CE1 4.18Å; I696-F743 HydrophobicContact CG2-CD1 4.28Å; I696-F743 HydrophobicContact CG2-CE1 4.02Å; L729-F743 HydrophobicContact CB-CB 4.08Å; L729-F743 PolarHBondContact N-O 3.08Å; G730-F743 PolarHBondContact N-O 3.09Å; G730-F743 PolarHBondContact O-N 3.22Å; E732-F743 HydrophobicContact CB-CE2 3.75Å; E732-F743 HydrophobicContact CB-CZ 4.25Å; R741-F743 HydrophobicContact CB-CE2 4.42Å; R741-F743 HydrophobicContact CB-CZ 4.13Å
744	M	89.6	Confident	86.8	Confident	13 Å²	13	40.2 Å²	40.2	6%	0.064	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.1	-179.6	56.1	-159.3	-58.2	0	0	110.5	I694 A695 V726 Q727 Y728 Q746 V811	I694-M744 WeakPolarHBondContact CA-O 3.44Å; A695-M744 HydrophobicContact CB-CG 3.81Å; A695-M744 PolarHBondContact N-O 2.79Å; A695-M744 PolarHBondContact O-N 3.38Å; V726-M744 HydrophobicContact CB-CE 4.31Å; V726-M744 HydrophobicContact CG1-CB 4.13Å; V726-M744 HydrophobicContact CG1-CE 3.51Å; Q727-M744 WeakPolarHBondContact O-CA 3.4Å; Y728-M744 HydrophobicContact CD1-CB 4.44Å; Y728-M744 HydrophobicContact CE1-CE 4.39Å; M744-Q746 PolarHBondContact O-N 3.22Å; M744-V811 HydrophobicContact CE-CB 4.36Å; M744-V811 HydrophobicContact CE-CG1 3.99Å
745	E	89.7	Confident	87.1	Confident	49 Å²	49	40 Å²	40	23%	0.229	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	140.5	174.1	67	174.1	146.4	0	0	110.6	V726 Q727 K809	V726-E745 WeakPolarHBondContact CA-OE1 3.18Å; V726-E745 HydrophobicContact CG1-CG 3.66Å; Q727-E745 HydrophobicContact CB-CB 4.37Å; Q727-E745 HydrophobicContact CB-CG 4.01Å; Q727-E745 PolarHBondContact N-OE1 3.27Å; Q727-E745 PolarHBondContact O-N 3.44Å; E745-K809 WeakPolarHBondContact OE1-CD 3.48Å; E745-K809 IonicContact OE1-NZ 2.71Å; E745-K809 PolarHBondContact OE1-NZ 3.08Å; E745-K809 IonicContact OE2-NZ 3.12Å; E745-K809 PolarHBondContact OE2-NZ 3.48Å
746	Q	91.5	Very high	87.7	Confident	32 Å²	32	32.3 Å²	32.3	15%	0.15	18%	0.182	C	C	.	.			trans	-82.8	120	174.1	-172.1	179	-4.7	0	0	109.8	L674 A695 M744 P748	L674-Q746 HydrophobicContact CD1-CG 4.09Å; A695-Q746 HydrophobicContact CB-CB 4.47Å; M744-Q746 PolarHBondContact O-N 3.22Å; Q746-P748 WeakPolarHBondContact O-CD 3.44Å
747	V	90.8	Very high	87.8	Confident	18 Å²	18	36.1 Å²	36.1	11%	0.109	19%	0.189	C	C	.	.			trans	-93	114.5	172.6	-176.4	0	0	0	0	109.3	V726 G749 L800 N802 K809	V726-V747 HydrophobicContact CG2-CG2 3.74Å; V747-G749 PolarHBondContact O-N 3.17Å; V747-L800 HydrophobicContact CB-CB 3.96Å; V747-L800 HydrophobicContact CB-CD1 3.89Å; V747-L800 HydrophobicContact CG1-CB 3.88Å; V747-L800 HydrophobicContact CG2-CB 4.34Å; V747-L800 HydrophobicContact CG2-CD1 4.11Å; V747-N802 HydrophobicContact CG1-CB 4.06Å; V747-K809 HydrophobicContact CG2-CB 4.34Å; V747-K809 HydrophobicContact CG2-CD 3.92Å; V747-K809 HydrophobicContact CG2-CG 4.41Å
748	P	85	Confident	87.9	Confident	48 Å²	48	35.7 Å²	35.7	31%	0.312	19%	0.187	S	C	.	.	S	Bend	trans	-79.1	118.2	-175.3	30.9	-34.9	0	0	0	111.6	Q746 N802 T803 Y804	Q746-P748 WeakPolarHBondContact O-CD 3.44Å; P748-N802 VanDerWaalsContact O-CA 3.22Å; P748-N802 WeakPolarHBondContact O-CA 3.16Å; P748-T803 PolarHBondContact O-N 2.92Å; P748-Y804 HydrophobicContact CB-CD2 4.01Å; P748-Y804 HydrophobicContact CB-CE2 3.86Å; P748-Y804 HydrophobicContact CG-CD2 4Å; P748-Y804 HydrophobicContact CG-CE2 4.36Å
749	G	83.6	Confident	87.8	Confident	37 Å²	37	33.4 Å²	33.4	38%	0.381	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	148.4	-97.9	-179.5	0	0	0	0	0	110.6	V747 V801	V747-G749 PolarHBondContact O-N 3.17Å; G749-V801 WeakPolarHBondContact CA-O 3.46Å
750	G	88.4	Confident	87.7	Confident	15 Å²	15	33.6 Å²	33.6	16%	0.155	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-176.9	175.7	0	0	0	0	0	112.4	L800 V801	G750-L800 WeakPolarHBondContact O-CA 3.09Å; G750-V801 PolarHBondContact O-N 3.32Å
751	S	91.6	Very high	87.6	Confident	17 Å²	17	34.7 Å²	34.7	12%	0.119	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	149.9	173.8	72	0	0	0	0	111.5	S753 L754 L755 D797 V799	S751-S753 PolarHBondContact O-N 3.3Å; S751-L754 PolarHBondContact O-N 3.08Å; S751-L754 VanDerWaalsContact O-N 3.12Å; S751-L754 WeakPolarHBondContact OG-CB 3.38Å; S751-L754 PolarHBondContact OG-N 3.48Å; S751-L755 VanDerWaalsContact O-CG 3.29Å; S751-L755 WeakPolarHBondContact O-CG 3.35Å; S751-L755 PolarHBondContact O-N 3.27Å; S751-D797 WeakPolarHBondContact CB-O 3.3Å; S751-V799 CarbonylContact C-O 3.59Å; S751-V799 WeakPolarHBondContact CA-O 3.47Å
752	L	92.4	Very high	87.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-41.5	176.5	176.7	61.7	0	0	0	110.8	L754 L755 L756 W760 I777 G796 V799 V801 T860 M864	L752-L754 PolarHBondContact O-N 3.13Å; L752-L755 PolarHBondContact O-N 2.73Å; L752-L756 HydrophobicContact CD1-CD1 4.12Å; L752-L756 HydrophobicContact CD1-CG 4.15Å; L752-L756 HydrophobicContact CG-CD1 3.94Å; L752-L756 HydrophobicContact CG-CG 4.42Å; L752-L756 WeakPolarHBondContact O-CB 3.43Å; L752-L756 VanDerWaalsContact O-CG 3.23Å; L752-L756 WeakPolarHBondContact O-CG 3.32Å; L752-L756 PolarHBondContact O-N 2.8Å; L752-W760 HydrophobicContact CD1-CE3 4.3Å; L752-W760 HydrophobicContact CD1-CZ3 3.6Å; L752-I777 HydrophobicContact CD2-CD1 4.33Å; L752-G796 WeakPolarHBondContact CB-O 3.48Å; L752-G796 PolarHBondContact N-O 3.29Å; L752-G796 VanDerWaalsContact N-O 3.09Å; L752-V799 HydrophobicContact CB-CB 4.13Å; L752-V799 HydrophobicContact CB-CG1 4.32Å; L752-V799 HydrophobicContact CD2-CB 4.43Å; L752-V799 HydrophobicContact CD2-CG1 4.37Å; L752-V799 PolarHBondContact N-O 3.38Å; L752-V801 HydrophobicContact CB-CG2 4.42Å; L752-V801 HydrophobicContact CD1-CG2 4.41Å; L752-T860 HydrophobicContact CD2-CG2 4.11Å; L752-M864 HydrophobicContact CD1-CG 4.32Å; L752-M864 HydrophobicContact CD1-SD 4.45Å; L752-M864 HydrophobicContact CD2-CG 3.82Å; L752-M864 HydrophobicContact CD2-SD 3.91Å; L752-M864 HydrophobicContact CG-CG 4.35Å
753	S	89.3	Confident	87.6	Confident	13 Å²	13	36.5 Å²	36.5	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-43.6	175.5	-59.2	0	0	0	0	112.6	S751 L755 R757 G796 D797 E863	S751-S753 PolarHBondContact O-N 3.3Å; S753-L755 VanDerWaalsContact C-N 3.34Å; S753-R757 WeakPolarHBondContact O-CB 3.24Å; S753-R757 PolarHBondContact O-N 3.3Å; S753-G796 PolarHBondContact N-O 2.77Å; S753-G796 WeakPolarHBondContact OG-CA 3Å; S753-D797 WeakPolarHBondContact CB-OD1 3.43Å; S753-D797 PolarHBondContact OG-N 2.81Å; S753-E863 VanDerWaalsContact CB-OE1 3.3Å; S753-E863 WeakPolarHBondContact CB-OE1 3.37Å; S753-E863 PolarHBondContact OG-OE1 3.03Å
754	L	87.2	Confident	87.5	Confident	71 Å²	71	37.8 Å²	37.8	37%	0.372	21%	0.208	S	C	.	.	H	α-helix	trans	-64.5	-41.1	177.1	-175	70.6	0	0	0	111.2	S751 L752 N758	S751-L754 PolarHBondContact O-N 3.08Å; S751-L754 VanDerWaalsContact O-N 3.12Å; S751-L754 WeakPolarHBondContact OG-CB 3.38Å; S751-L754 PolarHBondContact OG-N 3.48Å; L752-L754 PolarHBondContact O-N 3.13Å; L754-N758 WeakPolarHBondContact CD1-ND2 3.23Å; L754-N758 WeakPolarHBondContact O-CB 2.92Å; L754-N758 PolarHBondContact O-N 3.3Å
755	L	89	Confident	87.2	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-46.2	178.4	-67	171.7	0	0	0	111.6	S751 L752 S753 K759 W760 V801 T803 F1120	S751-L755 VanDerWaalsContact O-CG 3.29Å; S751-L755 WeakPolarHBondContact O-CG 3.35Å; S751-L755 PolarHBondContact O-N 3.27Å; L752-L755 PolarHBondContact O-N 2.73Å; S753-L755 VanDerWaalsContact C-N 3.34Å; L755-K759 CarbonylContact O-C 3.55Å; L755-K759 WeakPolarHBondContact O-CA 3.21Å; L755-K759 PolarHBondContact O-N 3.41Å; L755-W760 HydrophobicContact CB-CD2 3.84Å; L755-W760 HydrophobicContact CB-CE3 3.84Å; L755-W760 HydrophobicContact CB-CG 4.47Å; L755-W760 HydrophobicContact CB-CH2 4.18Å; L755-W760 HydrophobicContact CB-CZ2 4.18Å; L755-W760 HydrophobicContact CB-CZ3 4.02Å; L755-W760 HydrophobicContact CD1-CH2 3.57Å; L755-W760 HydrophobicContact CD1-CZ2 3.66Å; L755-W760 HydrophobicContact CD1-CZ3 4.14Å; L755-W760 HydrophobicContact CD2-CZ2 4.45Å; L755-W760 HydrophobicContact CG-CH2 4.43Å; L755-W760 HydrophobicContact CG-CZ2 4.31Å; L755-W760 PolarHBondContact O-N 2.8Å; L755-V801 HydrophobicContact CD1-CB 3.59Å; L755-V801 HydrophobicContact CD1-CG1 4.43Å; L755-V801 HydrophobicContact CD1-CG2 3.87Å; L755-T803 HydrophobicContact CD1-CG2 4.36Å; L755-T803 HydrophobicContact CD2-CG2 4.14Å; L755-F1120 HydrophobicContact CD2-CD2 4.11Å; L755-F1120 HydrophobicContact CD2-CE2 3.4Å; L755-F1120 VanDerWaalsContact CD2-CE2 3.4Å; L755-F1120 HydrophobicContact CD2-CZ 4.32Å
756	L	89.9	Confident	87	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	25%	0.245	C	C	.	.	I	π-helix	trans	-60.9	-45.8	176	-70.4	167.7	0	0	0	111.9	L752 W760 G761 L763 E863 M864	L752-L756 HydrophobicContact CD1-CD1 4.12Å; L752-L756 HydrophobicContact CD1-CG 4.15Å; L752-L756 HydrophobicContact CG-CD1 3.94Å; L752-L756 HydrophobicContact CG-CG 4.42Å; L752-L756 WeakPolarHBondContact O-CB 3.43Å; L752-L756 VanDerWaalsContact O-CG 3.23Å; L752-L756 WeakPolarHBondContact O-CG 3.32Å; L752-L756 PolarHBondContact O-N 2.8Å; L756-W760 HydrophobicContact CD2-CE3 4.34Å; L756-G761 WeakPolarHBondContact CD2-O 3.11Å; L756-G761 CarbonylContact O-C 3.45Å; L756-G761 WeakPolarHBondContact O-CA 3.41Å; L756-G761 PolarHBondContact O-N 2.76Å; L756-L763 HydrophobicContact CD2-CD1 3.79Å; L756-L763 HydrophobicContact CD2-CG 3.69Å; L756-E863 HydrophobicContact CD1-CG 4.06Å; L756-M864 HydrophobicContact CD1-CG 4.13Å
757	R	84.1	Confident	86.9	Confident	180 Å²	180	44 Å²	44	68%	0.679	25%	0.246	S	C	*	.	I	π-helix	trans	-71	-41.6	-176.5	-171.8	177.4	64.9	-159.8	-4.5	113.2	S753	S753-R757 WeakPolarHBondContact O-CB 3.24Å; S753-R757 PolarHBondContact O-N 3.3Å
758	N	82.1	Confident	86.7	Confident	80 Å²	80	47.2 Å²	47.2	43%	0.428	26%	0.262	S	S	.	.	I	π-helix	trans	-107	-19.9	-166.6	-65.6	13.7	0	0	0	114.1	L754	L754-N758 WeakPolarHBondContact CD1-ND2 3.23Å; L754-N758 WeakPolarHBondContact O-CB 2.92Å; L754-N758 PolarHBondContact O-N 3.3Å
759	K	81.1	Confident	86.8	Confident	50 Å²	50	46 Å²	46	22%	0.217	25%	0.254	C	S	.	.	I	π-helix	trans	-131.1	-53.1	-168.4	-65	-69	-171.2	-175.7	0	114.2	L755 F1120 D1123	L755-K759 CarbonylContact O-C 3.55Å; L755-K759 WeakPolarHBondContact O-CA 3.21Å; L755-K759 PolarHBondContact O-N 3.41Å; K759-F1120 HydrophobicContact CB-CE2 4.41Å; K759-F1120 HydrophobicContact CD-CE2 4.21Å; K759-F1120 HydrophobicContact CD-CZ 4.36Å; K759-F1120 HydrophobicContact CG-CD2 4.45Å; K759-F1120 HydrophobicContact CG-CE2 3.68Å; K759-F1120 HydrophobicContact CG-CZ 4.07Å; K759-D1123 IonicContact NZ-OD2 3.39Å; K759-D1123 PolarHBondContact NZ-OD2 3.1Å
760	W	85.6	Confident	87.1	Confident	33 Å²	33	44.2 Å²	44.2	13%	0.125	24%	0.236	C	C	.	.	I	π-helix	trans	-88.4	-29.5	-174.2	-60.6	-17.6	0	0	0	113.5	L752 L755 L756 L763 Y773 V801 P1116	L752-W760 HydrophobicContact CD1-CE3 4.3Å; L752-W760 HydrophobicContact CD1-CZ3 3.6Å; L755-W760 HydrophobicContact CB-CD2 3.84Å; L755-W760 HydrophobicContact CB-CE3 3.84Å; L755-W760 HydrophobicContact CB-CG 4.47Å; L755-W760 HydrophobicContact CB-CH2 4.18Å; L755-W760 HydrophobicContact CB-CZ2 4.18Å; L755-W760 HydrophobicContact CB-CZ3 4.02Å; L755-W760 HydrophobicContact CD1-CH2 3.57Å; L755-W760 HydrophobicContact CD1-CZ2 3.66Å; L755-W760 HydrophobicContact CD1-CZ3 4.14Å; L755-W760 HydrophobicContact CD2-CZ2 4.45Å; L755-W760 HydrophobicContact CG-CH2 4.43Å; L755-W760 HydrophobicContact CG-CZ2 4.31Å; L755-W760 PolarHBondContact O-N 2.8Å; L756-W760 HydrophobicContact CD2-CE3 4.34Å; W760-L763 HydrophobicContact CB-CD2 4.21Å; W760-L763 HydrophobicContact CE3-CD1 4.41Å; W760-Y773 HydrophobicContact CH2-CE1 4.37Å; W760-Y773 AromaticContact CH2-CE2 3.61Å; W760-Y773 HydrophobicContact CH2-CE2 3.61Å; W760-Y773 AromaticContact CH2-CZ 3.51Å; W760-Y773 VanDerWaalsContact CH2-OH 3.29Å; W760-Y773 WeakPolarHBondContact CH2-OH 3.21Å; W760-Y773 HydrophobicContact CZ3-CD2 4.3Å; W760-Y773 AromaticContact CZ3-CE2 3.66Å; W760-Y773 HydrophobicContact CZ3-CE2 3.66Å; W760-V801 HydrophobicContact CH2-CB 4.22Å; W760-V801 HydrophobicContact CH2-CG1 4Å; W760-V801 HydrophobicContact CH2-CG2 4.07Å; W760-V801 HydrophobicContact CZ2-CG1 4.5Å; W760-P1116 HydrophobicContact CD2-CB 4.1Å; W760-P1116 HydrophobicContact CG-CB 4.04Å; W760-P1116 HydrophobicContact CZ2-CB 4.45Å; W760-P1116 PolarHBondContact NE1-O 2.64Å
761	G	84.9	Confident	87.3	Confident	23 Å²	23	43.6 Å²	43.6	24%	0.237	23%	0.229	C	C	.	.			trans	69.4	-169.1	-168.8	0	0	0	0	0	112.7	L756	L756-G761 WeakPolarHBondContact CD2-O 3.11Å; L756-G761 CarbonylContact O-C 3.45Å; L756-G761 WeakPolarHBondContact O-CA 3.41Å; L756-G761 PolarHBondContact O-N 2.76Å
762	P	87.6	Confident	87.2	Confident	75 Å²	75	48 Å²	48	49%	0.487	24%	0.244	S	C	.	.			trans	-62.4	132	175.3	-18.4	31.5	0	0	0	111.5	I764 A865 T866	P762-I764 VanDerWaalsContact C-N 3.29Å; P762-I764 PolarHBondContact O-N 2.94Å; P762-A865 VanDerWaalsContact CB-O 3.29Å; P762-A865 WeakPolarHBondContact CB-O 3.33Å; P762-T866 WeakPolarHBondContact CG-O 3.48Å
763	L	88	Confident	87.3	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.042	25%	0.245	C	C	.	.			trans	-90.7	14.6	179.4	-59	178.4	0	0	0	113.5	L756 W760 D765 S766 T769 M770 M864	L756-L763 HydrophobicContact CD2-CD1 3.79Å; L756-L763 HydrophobicContact CD2-CG 3.69Å; W760-L763 HydrophobicContact CB-CD2 4.21Å; W760-L763 HydrophobicContact CE3-CD1 4.41Å; L763-D765 PolarHBondContact O-N 2.98Å; L763-D765 VanDerWaalsContact O-N 3.13Å; L763-S766 CarbonylContact O-C 3.58Å; L763-S766 WeakPolarHBondContact O-CA 3.33Å; L763-S766 PolarHBondContact O-N 2.82Å; L763-T769 HydrophobicContact CD1-CG2 4.06Å; L763-T769 HydrophobicContact CD2-CG2 4.43Å; L763-M770 HydrophobicContact CB-CG 3.63Å; L763-M770 HydrophobicContact CB-SD 4.21Å; L763-M770 HydrophobicContact CD1-CG 4.34Å; L763-M770 VanDerWaalsContact O-SD 3.4Å; L763-M864 WeakPolarHBondContact CB-O 3.33Å; L763-M864 HydrophobicContact CD1-CB 4.45Å; L763-M864 PolarHBondContact N-O 2.88Å
764	I	85.5	Confident	87.6	Confident	28 Å²	28	47.5 Å²	47.5	14%	0.144	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.5	-177.8	-162.1	158.9	0	0	0	113.6	P762 A865 P894 K896 L897	P762-I764 VanDerWaalsContact C-N 3.29Å; P762-I764 PolarHBondContact O-N 2.94Å; I764-A865 WeakPolarHBondContact CB-O 3.42Å; I764-A865 PolarHBondContact N-O 3.4Å; I764-P894 HydrophobicContact CD1-CB 3.53Å; I764-P894 HydrophobicContact CD1-CG 4.36Å; I764-K896 HydrophobicContact CD1-CB 3.71Å; I764-K896 HydrophobicContact CD1-CD 4.3Å; I764-K896 HydrophobicContact CD1-CG 4.38Å; I764-K896 HydrophobicContact CG1-CB 4.03Å; I764-L897 HydrophobicContact CG1-CD2 3.93Å; I764-L897 HydrophobicContact CG1-CG 4.18Å
765	D	84	Confident	87.9	Confident	146 Å²	146	48.7 Å²	48.7	78%	0.781	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.7	179.1	-56.7	-47	0	0	0	112.8	L763	L763-D765 PolarHBondContact O-N 2.98Å; L763-D765 VanDerWaalsContact O-N 3.13Å
766	S	86.3	Confident	88.2	Confident	43 Å²	43	49 Å²	49	30%	0.301	24%	0.244	S	C	.	.			trans	-130.9	62.9	-178	-169.4	0	0	0	0	111.7	L763 N768 T769 M770	L763-S766 CarbonylContact O-C 3.58Å; L763-S766 WeakPolarHBondContact O-CA 3.33Å; L763-S766 PolarHBondContact O-N 2.82Å; S766-N768 PolarHBondContact O-N 2.95Å; S766-N768 VanDerWaalsContact O-N 3.14Å; S766-T769 WeakPolarHBondContact O-CB 3.5Å; S766-T769 PolarHBondContact O-N 3.41Å; S766-T769 WeakPolarHBondContact OG-CB 3.47Å; S766-T769 PolarHBondContact OG-OG1 3.22Å; S766-M770 PolarHBondContact O-N 3.43Å; S766-M770 VanDerWaalsContact O-N 3.13Å
767	E	88.2	Confident	88.5	Confident	35 Å²	35	49 Å²	49	16%	0.164	24%	0.243	C	C	.	.	H	α-helix	trans	-57.4	-29.9	178	-64.1	-167	174.1	0	0	113.1	T769 M770 A771 L897 S898	E767-T769 VanDerWaalsContact C-N 3.3Å; E767-T769 PolarHBondContact O-N 2.85Å; E767-M770 WeakPolarHBondContact O-CB 3.33Å; E767-M770 PolarHBondContact O-N 2.87Å; E767-A771 WeakPolarHBondContact O-CB 3.1Å; E767-A771 PolarHBondContact O-N 3.23Å; E767-L897 HydrophobicContact CG-CD2 4.35Å; E767-L897 WeakPolarHBondContact OE1-CA 3.48Å; E767-S898 VanDerWaalsContact CD-OG 3.31Å; E767-S898 WeakPolarHBondContact OE1-CB 3.35Å; E767-S898 PolarHBondContact OE1-N 2.97Å; E767-S898 PolarHBondContact OE1-OG 2.9Å; E767-S898 WeakPolarHBondContact OE2-CB 3.42Å; E767-S898 PolarHBondContact OE2-OG 2.68Å
768	N	86.5	Confident	89.1	Confident	85 Å²	85	40.4 Å²	40.4	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-37.6	174.2	-72.3	-29.8	0	0	0	112.5	S766 Y772	S766-N768 PolarHBondContact O-N 2.95Å; S766-N768 VanDerWaalsContact O-N 3.14Å; N768-Y772 WeakPolarHBondContact O-CB 3.44Å; N768-Y772 PolarHBondContact O-N 3.38Å
769	T	87.5	Confident	89.8	Confident	22 Å²	22	39.6 Å²	39.6	14%	0.135	21%	0.205	C	C	.	.	H	α-helix	trans	-73.7	-39.4	176.6	-60.2	0	0	0	0	110.3	L763 S766 E767 Y772 Y773 P1116	L763-T769 HydrophobicContact CD1-CG2 4.06Å; L763-T769 HydrophobicContact CD2-CG2 4.43Å; S766-T769 WeakPolarHBondContact O-CB 3.5Å; S766-T769 PolarHBondContact O-N 3.41Å; S766-T769 WeakPolarHBondContact OG-CB 3.47Å; S766-T769 PolarHBondContact OG-OG1 3.22Å; E767-T769 VanDerWaalsContact C-N 3.3Å; E767-T769 PolarHBondContact O-N 2.85Å; T769-Y772 PolarHBondContact O-N 2.86Å; T769-Y773 HydrophobicContact CG2-CD2 3.83Å; T769-Y773 HydrophobicContact CG2-CE2 3.55Å; T769-Y773 WeakPolarHBondContact O-CD2 3.29Å; T769-Y773 PolarHBondContact O-N 3.46Å; T769-Y773 VanDerWaalsContact O-N 3.15Å; T769-P1116 HydrophobicContact CG2-CG 4.14Å
770	M	90.9	Very high	90.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-48.7	172.6	-66.5	178	55.2	0	0	111.2	L763 S766 E767 Y772 Y773 A774 M861 M864 A865 L897	L763-M770 HydrophobicContact CB-CG 3.63Å; L763-M770 HydrophobicContact CB-SD 4.21Å; L763-M770 HydrophobicContact CD1-CG 4.34Å; L763-M770 VanDerWaalsContact O-SD 3.4Å; S766-M770 PolarHBondContact O-N 3.43Å; S766-M770 VanDerWaalsContact O-N 3.13Å; E767-M770 WeakPolarHBondContact O-CB 3.33Å; E767-M770 PolarHBondContact O-N 2.87Å; M770-Y772 VanDerWaalsContact C-N 3.32Å; M770-Y772 PolarHBondContact O-N 3.41Å; M770-Y773 PolarHBondContact O-N 2.96Å; M770-A774 WeakPolarHBondContact O-CB 3.27Å; M770-A774 PolarHBondContact O-N 2.88Å; M770-M861 HydrophobicContact CE-CE 3.86Å; M770-M864 HydrophobicContact CG-CB 4.36Å; M770-A865 HydrophobicContact CE-CB 3.87Å; M770-A865 HydrophobicContact SD-CB 4.26Å; M770-L897 HydrophobicContact CE-CD2 4.28Å; M770-L897 HydrophobicContact SD-CD2 4.21Å
771	A	90.9	Very high	90.7	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-40.3	177.7	0	0	0	0	0	112.2	E767 A774 K775 F927 F928 T931	E767-A771 WeakPolarHBondContact O-CB 3.1Å; E767-A771 PolarHBondContact O-N 3.23Å; A771-A774 PolarHBondContact O-N 3.44Å; A771-K775 WeakPolarHBondContact O-CB 3.45Å; A771-K775 PolarHBondContact O-N 3.08Å; A771-F927 HydrophobicContact CB-CD1 4.27Å; A771-F927 HydrophobicContact CB-CE1 3.68Å; A771-F927 HydrophobicContact CB-CZ 3.86Å; A771-F928 HydrophobicContact CB-CD1 4.22Å; A771-F928 HydrophobicContact CB-CE1 4.43Å; A771-F928 WeakPolarHBondContact O-CE1 3.29Å; A771-T931 HydrophobicContact CB-CG2 3.54Å
772	Y	91.2	Very high	91.1	Very high	109 Å²	109	35.5 Å²	35.5	43%	0.427	19%	0.185	S	C	.	.	H	α-helix	trans	-61.2	-45	178	178.9	-104.6	0	0	0	113.1	N768 T769 M770 Q776 G806	N768-Y772 WeakPolarHBondContact O-CB 3.44Å; N768-Y772 PolarHBondContact O-N 3.38Å; T769-Y772 PolarHBondContact O-N 2.86Å; M770-Y772 VanDerWaalsContact C-N 3.32Å; M770-Y772 PolarHBondContact O-N 3.41Å; Y772-Q776 VanDerWaalsContact CZ-NE2 3.28Å; Y772-G806 VanDerWaalsContact CE1-O 3.28Å; Y772-G806 WeakPolarHBondContact CE1-O 3.5Å
773	Y	94.3	Very high	91.3	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-77.5	-37.6	176.3	-68.7	-58.6	0	0	0	112.5	W760 T769 M770 K775 Q776 I777 V801 G806 C808	W760-Y773 HydrophobicContact CH2-CE1 4.37Å; W760-Y773 AromaticContact CH2-CE2 3.61Å; W760-Y773 HydrophobicContact CH2-CE2 3.61Å; W760-Y773 AromaticContact CH2-CZ 3.51Å; W760-Y773 VanDerWaalsContact CH2-OH 3.29Å; W760-Y773 WeakPolarHBondContact CH2-OH 3.21Å; W760-Y773 HydrophobicContact CZ3-CD2 4.3Å; W760-Y773 AromaticContact CZ3-CE2 3.66Å; W760-Y773 HydrophobicContact CZ3-CE2 3.66Å; T769-Y773 HydrophobicContact CG2-CD2 3.83Å; T769-Y773 HydrophobicContact CG2-CE2 3.55Å; T769-Y773 WeakPolarHBondContact O-CD2 3.29Å; T769-Y773 PolarHBondContact O-N 3.46Å; T769-Y773 VanDerWaalsContact O-N 3.15Å; M770-Y773 PolarHBondContact O-N 2.96Å; Y773-K775 VanDerWaalsContact C-N 3.3Å; Y773-K775 PolarHBondContact O-N 3.4Å; Y773-Q776 PolarHBondContact O-N 2.9Å; Y773-I777 VanDerWaalsContact O-CG1 3.31Å; Y773-I777 WeakPolarHBondContact O-CG1 3.24Å; Y773-I777 PolarHBondContact O-N 2.67Å; Y773-V801 HydrophobicContact CE1-CG1 3.57Å; Y773-V801 HydrophobicContact CE1-CG2 4.23Å; Y773-G806 WeakPolarHBondContact CE1-O 3.4Å; Y773-C808 HydrophobicContact CD1-CB 4.07Å
774	A	94.2	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.6	-43.9	176	0	0	0	0	0	112	M770 A771 I777 L778 F857 M861 M864 F928	M770-A774 WeakPolarHBondContact O-CB 3.27Å; M770-A774 PolarHBondContact O-N 2.88Å; A771-A774 PolarHBondContact O-N 3.44Å; A774-I777 PolarHBondContact O-N 2.91Å; A774-L778 WeakPolarHBondContact O-CB 3.38Å; A774-L778 WeakPolarHBondContact O-CG 3.4Å; A774-L778 PolarHBondContact O-N 2.93Å; A774-F857 HydrophobicContact CB-CE2 4.41Å; A774-F857 HydrophobicContact CB-CZ 4Å; A774-M861 HydrophobicContact CB-CE 4.12Å; A774-M861 HydrophobicContact CB-SD 3.53Å; A774-M861 VanDerWaalsContact CB-SD 3.53Å; A774-M864 HydrophobicContact CB-CE 4.46Å; A774-F928 HydrophobicContact CB-CE1 4.05Å; A774-F928 HydrophobicContact CB-CZ 4.28Å
775	K	94.9	Very high	91.4	Very high	95 Å²	95	33.9 Å²	33.9	41%	0.413	17%	0.169	S	C	.	.	H	α-helix	trans	-60.1	-48.5	177.1	-175.3	172.5	177.5	174.4	0	111.6	A771 Y773 I777 L778 E779 L923 F928	A771-K775 WeakPolarHBondContact O-CB 3.45Å; A771-K775 PolarHBondContact O-N 3.08Å; Y773-K775 VanDerWaalsContact C-N 3.3Å; Y773-K775 PolarHBondContact O-N 3.4Å; K775-I777 PolarHBondContact O-N 2.87Å; K775-L778 PolarHBondContact O-N 3.43Å; K775-E779 WeakPolarHBondContact CE-OE1 3.45Å; K775-E779 WeakPolarHBondContact O-CG 3.17Å; K775-E779 PolarHBondContact O-N 3.09Å; K775-L923 HydrophobicContact CG-CD2 4.07Å; K775-F928 HydrophobicContact CB-CD1 3.95Å; K775-F928 HydrophobicContact CB-CE1 3.68Å; K775-F928 HydrophobicContact CB-CZ 4.29Å
776	Q	95.5	Very high	91.4	Very high	10 Å²	10	30.3 Å²	30.3	5%	0.047	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-40.1	179.9	-74.5	-172.9	70.7	0	0	113.2	N724 Y772 Y773 L778 E779 G780 G806 L807 C808	N724-Q776 VanDerWaalsContact CB-O 3.26Å; N724-Q776 WeakPolarHBondContact CB-O 3.48Å; N724-Q776 WeakPolarHBondContact ND2-CB 3.14Å; N724-Q776 PolarHBondContact ND2-OE1 2.89Å; N724-Q776 VanDerWaalsContact ND2-OE1 3.08Å; Y772-Q776 VanDerWaalsContact CZ-NE2 3.28Å; Y773-Q776 PolarHBondContact O-N 2.9Å; Q776-L778 VanDerWaalsContact C-N 3.34Å; Q776-E779 PolarHBondContact O-N 2.93Å; Q776-G780 PolarHBondContact O-N 3.46Å; Q776-G806 PolarHBondContact NE2-O 3.1Å; Q776-L807 VanDerWaalsContact OE1-CA 3.26Å; Q776-C808 WeakPolarHBondContact CB-SG 3.46Å
777	I	96.1	Very high	91	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-42.4	174.8	-63	163.8	0	0	0	110.1	L752 Y773 A774 K775 G780 L781 V799 I810 F857	L752-I777 HydrophobicContact CD2-CD1 4.33Å; Y773-I777 VanDerWaalsContact O-CG1 3.31Å; Y773-I777 WeakPolarHBondContact O-CG1 3.24Å; Y773-I777 PolarHBondContact O-N 2.67Å; A774-I777 PolarHBondContact O-N 2.91Å; K775-I777 PolarHBondContact O-N 2.87Å; I777-G780 PolarHBondContact O-N 3.19Å; I777-L781 HydrophobicContact CG2-CD1 4.27Å; I777-L781 PolarHBondContact O-N 3.48Å; I777-V799 HydrophobicContact CD1-CG1 4.11Å; I777-V799 HydrophobicContact CD1-CG2 4.21Å; I777-V799 HydrophobicContact CG1-CG1 4.01Å; I777-V799 HydrophobicContact CG1-CG2 4.26Å; I777-I810 HydrophobicContact CG2-CD1 4.23Å; I777-F857 HydrophobicContact CB-CD2 4.27Å; I777-F857 HydrophobicContact CB-CE2 4.01Å; I777-F857 HydrophobicContact CG2-CD2 3.64Å; I777-F857 HydrophobicContact CG2-CE2 3.9Å
778	L	96.7	Very high	90.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.8	-35.3	176.7	-76.9	177	0	0	0	113.3	A774 K775 Q776 L781 A782 F857 F904 A919 L922 L923 F928	A774-L778 WeakPolarHBondContact O-CB 3.38Å; A774-L778 WeakPolarHBondContact O-CG 3.4Å; A774-L778 PolarHBondContact O-N 2.93Å; K775-L778 PolarHBondContact O-N 3.43Å; Q776-L778 VanDerWaalsContact C-N 3.34Å; L778-L781 PolarHBondContact O-N 3.28Å; L778-A782 WeakPolarHBondContact O-CB 3.48Å; L778-A782 PolarHBondContact O-N 3.11Å; L778-F857 HydrophobicContact CD1-CE1 3.94Å; L778-F857 HydrophobicContact CD1-CZ 3.82Å; L778-F857 HydrophobicContact CD2-CD1 3.9Å; L778-F857 HydrophobicContact CD2-CD2 4.38Å; L778-F857 HydrophobicContact CD2-CE1 3.77Å; L778-F857 HydrophobicContact CD2-CE2 4.26Å; L778-F857 HydrophobicContact CD2-CG 4.2Å; L778-F857 HydrophobicContact CD2-CZ 3.95Å; L778-F857 HydrophobicContact CG-CD1 4.43Å; L778-F857 HydrophobicContact CG-CE1 3.85Å; L778-F857 HydrophobicContact CG-CE2 3.92Å; L778-F857 HydrophobicContact CG-CZ 3.55Å; L778-F904 HydrophobicContact CD1-CE2 4.37Å; L778-F904 HydrophobicContact CD1-CZ 3.84Å; L778-A919 HydrophobicContact CD2-CB 3.98Å; L778-L922 HydrophobicContact CD1-CB 3.7Å; L778-L922 HydrophobicContact CD2-CB 4.16Å; L778-L922 HydrophobicContact CD2-CD1 4.03Å; L778-L923 HydrophobicContact CB-CD2 3.5Å; L778-L923 VanDerWaalsContact CB-CD2 3.5Å; L778-L923 HydrophobicContact CB-CG 3.86Å; L778-L923 HydrophobicContact CD1-CD2 4.36Å; L778-F928 HydrophobicContact CD1-CE2 4.07Å; L778-F928 HydrophobicContact CD1-CZ 3.87Å
779	E	95.8	Very high	89.8	Confident	64 Å²	64	33.9 Å²	33.9	30%	0.299	16%	0.162	S	C	.	.	H	α-helix	trans	-61.6	-44.9	172.7	-75.6	167.5	172.3	0	0	110.4	K775 Q776 A782 Y783 L923	K775-E779 WeakPolarHBondContact CE-OE1 3.45Å; K775-E779 WeakPolarHBondContact O-CG 3.17Å; K775-E779 PolarHBondContact O-N 3.09Å; Q776-E779 PolarHBondContact O-N 2.93Å; E779-A782 PolarHBondContact O-N 2.82Å; E779-Y783 WeakPolarHBondContact O-CB 3.3Å; E779-Y783 PolarHBondContact O-N 2.88Å; E779-L923 HydrophobicContact CG-CD1 4.15Å; E779-L923 HydrophobicContact CG-CD2 3.85Å
780	G	93.2	Very high	89.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-45.8	172.7	0	0	0	0	0	113.2	Q776 I777 Y783 L784	Q776-G780 PolarHBondContact O-N 3.46Å; I777-G780 PolarHBondContact O-N 3.19Å; G780-Y783 PolarHBondContact O-N 2.91Å; G780-L784 WeakPolarHBondContact O-CG 3.3Å; G780-L784 PolarHBondContact O-N 3.46Å
781	L	93.4	Very high	88.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-42	177	-79.9	176.9	0	0	0	112.8	I777 L778 Y783 L784 H785 H791 I794 I810 D853 F857 A919	I777-L781 HydrophobicContact CG2-CD1 4.27Å; I777-L781 PolarHBondContact O-N 3.48Å; L778-L781 PolarHBondContact O-N 3.28Å; L781-Y783 VanDerWaalsContact C-N 3.29Å; L781-Y783 PolarHBondContact O-N 2.51Å; L781-L784 PolarHBondContact O-N 2.83Å; L781-H785 WeakPolarHBondContact O-CB 3.25Å; L781-H785 PolarHBondContact O-CD2 3.27Å; L781-H785 PolarHBondContact O-N 3.41Å; L781-H791 HydrophobicContact CD2-CB 4.39Å; L781-I794 HydrophobicContact CD1-CD1 4.48Å; L781-I794 HydrophobicContact CD1-CG1 4.46Å; L781-I794 HydrophobicContact CD2-CD1 3.67Å; L781-I794 HydrophobicContact CD2-CG1 3.92Å; L781-I794 HydrophobicContact CG-CD1 4.28Å; L781-I810 HydrophobicContact CG-CD1 4.22Å; L781-D853 HydrophobicContact CD2-CB 3.95Å; L781-F857 HydrophobicContact CD1-CB 4.06Å; L781-F857 HydrophobicContact CD1-CD2 4.45Å; L781-F857 HydrophobicContact CD1-CG 4.42Å; L781-A919 HydrophobicContact CB-CB 3.85Å
782	A	93.4	Very high	88.2	Confident	20 Å²	20	35.8 Å²	35.8	17%	0.165	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-40.3	177	0	0	0	0	0	110.9	L778 E779 S786 A919 A920 L923	L778-A782 WeakPolarHBondContact O-CB 3.48Å; L778-A782 PolarHBondContact O-N 3.11Å; E779-A782 PolarHBondContact O-N 2.82Å; A782-S786 VanDerWaalsContact O-CB 3.29Å; A782-S786 WeakPolarHBondContact O-CB 3.37Å; A782-S786 PolarHBondContact O-N 3.23Å; A782-A919 HydrophobicContact CB-CB 4.13Å; A782-A920 HydrophobicContact CB-CB 4.42Å; A782-L923 HydrophobicContact CB-CD1 3.93Å
783	Y	90.7	Very high	87.7	Confident	50 Å²	50	31.7 Å²	31.7	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-51	172.6	178.5	-91.2	0	0	0	111.5	L720 A721 H722 I725 E779 G780 L781 H785 S786 Q787	L720-Y783 HydrophobicContact CB-CE1 4.19Å; L720-Y783 HydrophobicContact CD2-CE1 3.81Å; A721-Y783 PolarHBondContact N-OH 3.08Å; A721-Y783 PolarHBondContact O-OH 3.4Å; H722-Y783 HydrophobicContact CB-CD1 3.83Å; H722-Y783 HydrophobicContact CB-CD2 4.26Å; H722-Y783 HydrophobicContact CB-CE1 3.94Å; H722-Y783 HydrophobicContact CB-CE2 4.39Å; H722-Y783 HydrophobicContact CB-CG 3.95Å; H722-Y783 AromaticContact CD2-CD2 3.73Å; H722-Y783 AromaticContact CD2-CG 3.77Å; H722-Y783 AromaticContact CG-CG 3.86Å; I725-Y783 HydrophobicContact CD1-CD1 3.27Å; I725-Y783 HydrophobicContact CD1-CE1 3.84Å; I725-Y783 HydrophobicContact CD1-CG 4.21Å; E779-Y783 WeakPolarHBondContact O-CB 3.3Å; E779-Y783 PolarHBondContact O-N 2.88Å; G780-Y783 PolarHBondContact O-N 2.91Å; L781-Y783 VanDerWaalsContact C-N 3.29Å; L781-Y783 PolarHBondContact O-N 2.51Å; Y783-H785 VanDerWaalsContact C-N 3.34Å; Y783-H785 PolarHBondContact O-N 3.31Å; Y783-S786 WeakPolarHBondContact O-CB 3.2Å; Y783-S786 PolarHBondContact O-N 3.39Å; Y783-S786 VanDerWaalsContact O-N 3.09Å; Y783-S786 PolarHBondContact O-OG 3.47Å; Y783-Q787 HydrophobicContact CD1-CG 4.27Å; Y783-Q787 HydrophobicContact CE1-CG 3.97Å; Y783-Q787 HydrophobicContact CE2-CG 4.39Å; Y783-Q787 WeakPolarHBondContact O-CG 3.49Å; Y783-Q787 PolarHBondContact O-N 3.31Å
784	L	86.7	Confident	87.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56	-48.3	177.3	-72.9	176	0	0	0	111.7	L720 I725 G780 L781 S786 Q787 K788 I789 H791 F813	L720-L784 HydrophobicContact CD1-CD2 4.18Å; I725-L784 HydrophobicContact CD1-CD1 4.4Å; I725-L784 HydrophobicContact CD1-CD2 3.65Å; I725-L784 HydrophobicContact CD1-CG 3.64Å; G780-L784 WeakPolarHBondContact O-CG 3.3Å; G780-L784 PolarHBondContact O-N 3.46Å; L781-L784 PolarHBondContact O-N 2.83Å; L784-S786 VanDerWaalsContact C-N 3.29Å; L784-S786 PolarHBondContact O-N 3.23Å; L784-Q787 CarbonylContact O-C 3.49Å; L784-Q787 WeakPolarHBondContact O-CA 3.39Å; L784-Q787 PolarHBondContact O-N 3.47Å; L784-Q787 VanDerWaalsContact O-N 3.07Å; L784-K788 PolarHBondContact O-N 2.82Å; L784-I789 CarbonylContact C-O 3.57Å; L784-I789 VanDerWaalsContact C-O 3.25Å; L784-I789 HydrophobicContact CB-CB 4.28Å; L784-I789 HydrophobicContact CD2-CB 4.14Å; L784-I789 HydrophobicContact CD2-CD1 4.29Å; L784-I789 HydrophobicContact CD2-CG2 3.95Å; L784-I789 PolarHBondContact O-N 3.33Å; L784-H791 HydrophobicContact CD1-CB 4.4Å; L784-F813 HydrophobicContact CD1-CB 4.42Å; L784-F813 HydrophobicContact CD2-CD2 4.28Å; L784-F813 HydrophobicContact CD2-CE2 4.39Å; L784-F813 HydrophobicContact CD2-CG 4.47Å
785	H	88.1	Confident	87.3	Confident	27 Å²	27	32.6 Å²	32.6	13%	0.125	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-33.9	178.1	-64.8	173.9	0	0	0	112.1	L781 Y783 Q787 K788 I789 A850 D853	L781-H785 WeakPolarHBondContact O-CB 3.25Å; L781-H785 PolarHBondContact O-CD2 3.27Å; L781-H785 PolarHBondContact O-N 3.41Å; Y783-H785 VanDerWaalsContact C-N 3.34Å; Y783-H785 PolarHBondContact O-N 3.31Å; H785-Q787 VanDerWaalsContact C-N 3.31Å; H785-K788 PolarHBondContact O-N 3.24Å; H785-K788 VanDerWaalsContact O-N 3.09Å; H785-I789 PolarHBondContact CD2-O 2.84Å; H785-A850 HydrophobicContact CB-CB 4.34Å; H785-A850 PolarHBondContact CE1-O 2.76Å; H785-A850 VanDerWaalsContact CE1-O 3.28Å; H785-D853 IonicContact CD2-OD2 2.84Å; H785-D853 IonicContact CE1-OD2 2.73Å; H785-D853 IonicContact NE2-OD2 3.4Å; H785-D853 PolarHBondContact NE2-OD2 2.81Å
786	S	84.3	Confident	87	Confident	71 Å²	71	28.1 Å²	28.1	50%	0.497	14%	0.138	S	C	.	.	H	α-helix	trans	-65	-36.5	173.7	81.8	0	0	0	0	111.8	A782 Y783 L784 K788	A782-S786 VanDerWaalsContact O-CB 3.29Å; A782-S786 WeakPolarHBondContact O-CB 3.37Å; A782-S786 PolarHBondContact O-N 3.23Å; Y783-S786 WeakPolarHBondContact O-CB 3.2Å; Y783-S786 PolarHBondContact O-N 3.39Å; Y783-S786 VanDerWaalsContact O-N 3.09Å; Y783-S786 PolarHBondContact O-OG 3.47Å; L784-S786 VanDerWaalsContact C-N 3.29Å; L784-S786 PolarHBondContact O-N 3.23Å; S786-K788 PolarHBondContact O-N 3Å
787	Q	78.3	Confident	86.7	Confident	86 Å²	86	31.7 Å²	31.7	40%	0.402	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	9.3	173.2	-58.2	-57.2	-54.2	0	0	113	L720 Y783 L784 H785 I789	L720-Q787 HydrophobicContact CD2-CB 4.02Å; L720-Q787 HydrophobicContact CD2-CG 3.81Å; Y783-Q787 HydrophobicContact CD1-CG 4.27Å; Y783-Q787 HydrophobicContact CE1-CG 3.97Å; Y783-Q787 HydrophobicContact CE2-CG 4.39Å; Y783-Q787 WeakPolarHBondContact O-CG 3.49Å; Y783-Q787 PolarHBondContact O-N 3.31Å; L784-Q787 CarbonylContact O-C 3.49Å; L784-Q787 WeakPolarHBondContact O-CA 3.39Å; L784-Q787 PolarHBondContact O-N 3.47Å; L784-Q787 VanDerWaalsContact O-N 3.07Å; H785-Q787 VanDerWaalsContact C-N 3.31Å; Q787-I789 HydrophobicContact CB-CD1 4.11Å; Q787-I789 HydrophobicContact CB-CG1 4.28Å; Q787-I789 PolarHBondContact O-N 3.22Å
788	K	73.2	Confident	86.4	Confident	138 Å²	138	32.3 Å²	32.3	60%	0.6	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	24.8	-177.5	-49.9	-60.5	-177.1	-179.3	0	114.2	Y614 L784 H785 S786	Y614-K788 HydrophobicContact CD1-CB 3.91Å; Y614-K788 HydrophobicContact CD1-CG 4.46Å; Y614-K788 HydrophobicContact CG-CB 4.43Å; L784-K788 PolarHBondContact O-N 2.82Å; H785-K788 PolarHBondContact O-N 3.24Å; H785-K788 VanDerWaalsContact O-N 3.09Å; S786-K788 PolarHBondContact O-N 3Å
789	I	75.8	Confident	86.2	Confident	14 Å²	14	32.3 Å²	32.3	7%	0.072	16%	0.161	C	C	.	.			trans	-99.9	130	177.7	-60.3	172	0	0	0	109.3	L720 L784 H785 Q787 F813	L720-I789 HydrophobicContact CD1-CD1 3.34Å; L720-I789 HydrophobicContact CD2-CD1 3.62Å; L720-I789 HydrophobicContact CG-CD1 4.03Å; L784-I789 CarbonylContact C-O 3.57Å; L784-I789 VanDerWaalsContact C-O 3.25Å; L784-I789 HydrophobicContact CB-CB 4.28Å; L784-I789 HydrophobicContact CD2-CB 4.14Å; L784-I789 HydrophobicContact CD2-CD1 4.29Å; L784-I789 HydrophobicContact CD2-CG2 3.95Å; L784-I789 PolarHBondContact O-N 3.33Å; H785-I789 PolarHBondContact CD2-O 2.84Å; Q787-I789 HydrophobicContact CB-CD1 4.11Å; Q787-I789 HydrophobicContact CB-CG1 4.28Å; Q787-I789 PolarHBondContact O-N 3.22Å; I789-F813 HydrophobicContact CG2-CD2 4.31Å
790	V	77.7	Confident	86.1	Confident	15 Å²	15	31.1 Å²	31.1	9%	0.091	16%	0.157	C	C	.	.			trans	-105.2	130.4	171.8	-175.4	0	0	0	0	107.6	R792 D853	V790-R792 HydrophobicContact CB-CG 4.32Å; V790-R792 HydrophobicContact CG1-CG 3.9Å; V790-D853 WeakPolarHBondContact CA-OD2 3.32Å; V790-D853 WeakPolarHBondContact CG1-OD2 3Å
791	H	81.6	Confident	86.1	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.009	16%	0.157	C	C	.	.			trans	-73.3	-43.5	-174.8	-175.1	-56.3	0	0	0	112.9	L781 L784 D793 I794 I810 V811 F813 G814 D853	L781-H791 HydrophobicContact CD2-CB 4.39Å; L784-H791 HydrophobicContact CD1-CB 4.4Å; H791-D793 VanDerWaalsContact C-N 3.31Å; H791-D793 PolarHBondContact CE1-O 3.23Å; H791-D793 PolarHBondContact ND1-N 3.25Å; H791-D793 PolarHBondContact O-N 3.46Å; H791-I794 HydrophobicContact CB-CD1 3.73Å; H791-I794 HydrophobicContact CB-CG1 3.81Å; H791-I794 WeakPolarHBondContact CD2-CD1 3.35Å; H791-I810 WeakPolarHBondContact CD2-CG2 3.47Å; H791-I810 WeakPolarHBondContact NE2-CG2 3.28Å; H791-V811 PolarHBondContact CE1-O 3.03Å; H791-V811 PolarHBondContact NE2-O 2.96Å; H791-F813 HydrophobicContact CB-CB 4.31Å; H791-F813 VanDerWaalsContact CD2-CB 3.44Å; H791-F813 WeakPolarHBondContact CD2-CB 3.25Å; H791-G814 PolarHBondContact O-N 3.33Å; H791-D853 PolarHBondContact N-OD1 3.36Å; H791-D853 PolarHBondContact N-OD2 3.24Å
792	R	78.1	Confident	85.9	Confident	47 Å²	47	32.7 Å²	32.7	18%	0.177	17%	0.165	C	C	.	.	S	Bend	trans	74	-6	176.3	-54.4	177.7	165.1	173.1	-9.5	117.8	N616 S617 V790 Y848 D853	N616-R792 PolarHBondContact O-NH2 3.16Å; S617-R792 PolarHBondContact O-NH2 3.32Å; S617-R792 PolarHBondContact OG-NH2 3.4Å; S617-R792 VanDerWaalsContact OG-NH2 3.08Å; V790-R792 HydrophobicContact CB-CG 4.32Å; V790-R792 HydrophobicContact CG1-CG 3.9Å; R792-Y848 HydrophobicContact CB-CE2 4.23Å; R792-Y848 VanDerWaalsContact CB-OH 3.3Å; R792-Y848 WeakPolarHBondContact CB-OH 3.34Å; R792-Y848 WeakPolarHBondContact CD-OH 3.46Å; R792-Y848 HydrophobicContact CG-CE2 3.77Å; R792-Y848 VanDerWaalsContact CG-OH 3.3Å; R792-Y848 WeakPolarHBondContact CG-OH 3.38Å; R792-D853 PolarHBondContact N-OD1 3.05Å
793	D	80.9	Confident	85.5	Confident	22 Å²	22	31.8 Å²	31.8	12%	0.118	16%	0.158	C	C	.	.			trans	-149.5	45.4	-178	-167.7	36.3	0	0	0	111	H791 K795 N798	H791-D793 VanDerWaalsContact C-N 3.31Å; H791-D793 PolarHBondContact CE1-O 3.23Å; H791-D793 PolarHBondContact ND1-N 3.25Å; H791-D793 PolarHBondContact O-N 3.46Å; D793-K795 VanDerWaalsContact CG-NZ 3.28Å; D793-K795 PolarHBondContact O-N 3.25Å; D793-K795 IonicContact OD1-NZ 3.39Å; D793-K795 PolarHBondContact OD1-NZ 3.06Å; D793-K795 WeakPolarHBondContact OD2-CE 3.49Å; D793-K795 IonicContact OD2-NZ 2.99Å; D793-K795 PolarHBondContact OD2-NZ 3.24Å; D793-N798 PolarHBondContact O-ND2 3.29Å; D793-N798 PolarHBondContact OD2-ND2 3.45Å
794	I	89.6	Confident	85	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.168	C	C	.	.			trans	-70.3	119.8	177	-64.9	-70	0	0	0	109.7	L781 H791 I810 Y835 D853 S856 F857	L781-I794 HydrophobicContact CD1-CD1 4.48Å; L781-I794 HydrophobicContact CD1-CG1 4.46Å; L781-I794 HydrophobicContact CD2-CD1 3.67Å; L781-I794 HydrophobicContact CD2-CG1 3.92Å; L781-I794 HydrophobicContact CG-CD1 4.28Å; H791-I794 HydrophobicContact CB-CD1 3.73Å; H791-I794 HydrophobicContact CB-CG1 3.81Å; H791-I794 WeakPolarHBondContact CD2-CD1 3.35Å; I794-I810 HydrophobicContact CD1-CD1 4.43Å; I794-I810 HydrophobicContact CD1-CG2 4.08Å; I794-Y835 WeakPolarHBondContact O-CD1 3.45Å; I794-D853 HydrophobicContact CG1-CB 4.29Å; I794-S856 WeakPolarHBondContact O-CB 3.47Å; I794-F857 HydrophobicContact CG2-CB 4.34Å
795	K	89.5	Confident	84.8	Confident	23 Å²	23	36.9 Å²	36.9	10%	0.1	19%	0.185	C	C	.	.	S	Bend	trans	-160.6	165.4	176.3	61	-172.7	-180	-140.1	0	110.1	D793 D797 N798 V799 T832 Y835 T860	D793-K795 VanDerWaalsContact CG-NZ 3.28Å; D793-K795 PolarHBondContact O-N 3.25Å; D793-K795 IonicContact OD1-NZ 3.39Å; D793-K795 PolarHBondContact OD1-NZ 3.06Å; D793-K795 WeakPolarHBondContact OD2-CE 3.49Å; D793-K795 IonicContact OD2-NZ 2.99Å; D793-K795 PolarHBondContact OD2-NZ 3.24Å; K795-D797 HydrophobicContact CD-CB 4.33Å; K795-D797 HydrophobicContact CG-CB 4.18Å; K795-D797 PolarHBondContact O-N 3.12Å; K795-D797 VanDerWaalsContact O-N 3.15Å; K795-N798 HydrophobicContact CG-CB 4.28Å; K795-N798 PolarHBondContact O-N 2.79Å; K795-V799 PolarHBondContact O-N 3.43Å; K795-T832 VanDerWaalsContact CD-OG1 3.25Å; K795-T832 WeakPolarHBondContact CD-OG1 3.29Å; K795-T832 WeakPolarHBondContact CE-OG1 3.42Å; K795-T832 PolarHBondContact NZ-OG1 2.83Å; K795-Y835 HydrophobicContact CB-CD1 3.69Å; K795-Y835 HydrophobicContact CB-CD2 4.43Å; K795-Y835 HydrophobicContact CB-CE1 3.43Å; K795-Y835 VanDerWaalsContact CB-CE1 3.43Å; K795-Y835 HydrophobicContact CB-CE2 4.23Å; K795-Y835 HydrophobicContact CB-CG 4.2Å; K795-T860 WeakPolarHBondContact CA-OG1 3.11Å
796	G	89.3	Confident	84.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-58.5	-28.4	-179.9	0	0	0	0	0	114.4	L752 S753 N798 V799 E863	L752-G796 WeakPolarHBondContact CB-O 3.48Å; L752-G796 PolarHBondContact N-O 3.29Å; L752-G796 VanDerWaalsContact N-O 3.09Å; S753-G796 PolarHBondContact N-O 2.77Å; S753-G796 WeakPolarHBondContact OG-CA 3Å; G796-N798 VanDerWaalsContact C-N 3.27Å; G796-N798 PolarHBondContact O-N 2.81Å; G796-V799 PolarHBondContact O-N 2.94Å; G796-E863 PolarHBondContact N-OE2 3.41Å; G796-E863 VanDerWaalsContact N-OE2 3.13Å
797	D	88.6	Confident	85	Confident	85 Å²	85	35.1 Å²	35.1	46%	0.455	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-67.4	-28.4	176.7	-77.4	-48.8	0	0	0	112.8	S751 S753 K795	S751-D797 WeakPolarHBondContact CB-O 3.3Å; S753-D797 WeakPolarHBondContact CB-OD1 3.43Å; S753-D797 PolarHBondContact OG-N 2.81Å; K795-D797 HydrophobicContact CD-CB 4.33Å; K795-D797 HydrophobicContact CG-CB 4.18Å; K795-D797 PolarHBondContact O-N 3.12Å; K795-D797 VanDerWaalsContact O-N 3.15Å
798	N	89.1	Confident	85.7	Confident	13 Å²	13	31 Å²	31	7%	0.07	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-97.1	12.9	179.9	-68.3	-12.7	0	0	0	112.8	D793 K795 G796 V811	D793-N798 PolarHBondContact O-ND2 3.29Å; D793-N798 PolarHBondContact OD2-ND2 3.45Å; K795-N798 HydrophobicContact CG-CB 4.28Å; K795-N798 PolarHBondContact O-N 2.79Å; G796-N798 VanDerWaalsContact C-N 3.27Å; G796-N798 PolarHBondContact O-N 2.81Å; N798-V811 HydrophobicContact CB-CG2 4.17Å; N798-V811 WeakPolarHBondContact O-CG2 3.18Å; N798-V811 PolarHBondContact O-N 3.25Å
799	V	93.3	Very high	86.7	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	107.4	173	179	0	0	0	0	108.3	S751 L752 I777 K795 G796 C808	S751-V799 CarbonylContact C-O 3.59Å; S751-V799 WeakPolarHBondContact CA-O 3.47Å; L752-V799 HydrophobicContact CB-CB 4.13Å; L752-V799 HydrophobicContact CB-CG1 4.32Å; L752-V799 HydrophobicContact CD2-CB 4.43Å; L752-V799 HydrophobicContact CD2-CG1 4.37Å; L752-V799 PolarHBondContact N-O 3.38Å; I777-V799 HydrophobicContact CD1-CG1 4.11Å; I777-V799 HydrophobicContact CD1-CG2 4.21Å; I777-V799 HydrophobicContact CG1-CG1 4.01Å; I777-V799 HydrophobicContact CG1-CG2 4.26Å; K795-V799 PolarHBondContact O-N 3.43Å; G796-V799 PolarHBondContact O-N 2.94Å; V799-C808 HydrophobicContact CG1-CB 3.89Å
800	L	93.2	Very high	87.5	Confident	39 Å²	39	25.5 Å²	25.5	20%	0.204	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	137.1	175.8	-59.6	-173.7	0	0	0	110.2	V747 G750 C808 K809 V811	V747-L800 HydrophobicContact CB-CB 3.96Å; V747-L800 HydrophobicContact CB-CD1 3.89Å; V747-L800 HydrophobicContact CG1-CB 3.88Å; V747-L800 HydrophobicContact CG2-CB 4.34Å; V747-L800 HydrophobicContact CG2-CD1 4.11Å; G750-L800 WeakPolarHBondContact O-CA 3.09Å; L800-C808 CarbonylContact O-C 3.35Å; L800-C808 WeakPolarHBondContact O-CA 3.18Å; L800-K809 PolarHBondContact N-O 3.34Å; L800-K809 PolarHBondContact O-N 3.22Å; L800-V811 HydrophobicContact CD1-CG1 3.58Å; L800-V811 HydrophobicContact CG-CG1 3.77Å; L800-V811 HydrophobicContact CG-CG2 4.25Å
801	V	92.9	Very high	87.9	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.1	174.9	-172.4	0	0	0	0	110.3	G749 G750 L752 L755 W760 Y773 T803 C808	G749-V801 WeakPolarHBondContact CA-O 3.46Å; G750-V801 PolarHBondContact O-N 3.32Å; L752-V801 HydrophobicContact CB-CG2 4.42Å; L752-V801 HydrophobicContact CD1-CG2 4.41Å; L755-V801 HydrophobicContact CD1-CB 3.59Å; L755-V801 HydrophobicContact CD1-CG1 4.43Å; L755-V801 HydrophobicContact CD1-CG2 3.87Å; W760-V801 HydrophobicContact CH2-CB 4.22Å; W760-V801 HydrophobicContact CH2-CG1 4Å; W760-V801 HydrophobicContact CH2-CG2 4.07Å; W760-V801 HydrophobicContact CZ2-CG1 4.5Å; Y773-V801 HydrophobicContact CE1-CG1 3.57Å; Y773-V801 HydrophobicContact CE1-CG2 4.23Å; V801-T803 PolarHBondContact O-N 2.64Å; V801-C808 HydrophobicContact CG2-CB 3.95Å
802	N	90.2	Very high	87.7	Confident	33 Å²	33	26.5 Å²	26.5	18%	0.176	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	102.9	166	-173.5	-33.9	0	0	0	109.4	V747 P748 Y804 S805 G806 L807	V747-N802 HydrophobicContact CG1-CB 4.06Å; P748-N802 VanDerWaalsContact O-CA 3.22Å; P748-N802 WeakPolarHBondContact O-CA 3.16Å; N802-Y804 PolarHBondContact O-N 3.11Å; N802-Y804 WeakPolarHBondContact OD1-CA 3.26Å; N802-Y804 VanDerWaalsContact OD1-CB 3.3Å; N802-Y804 WeakPolarHBondContact OD1-CB 3.45Å; N802-Y804 PolarHBondContact OD1-N 3.05Å; N802-S805 WeakPolarHBondContact CB-OG 3.12Å; N802-S805 PolarHBondContact ND2-OG 2.82Å; N802-S805 PolarHBondContact O-N 2.88Å; N802-S805 PolarHBondContact OD1-N 3.03Å; N802-S805 VanDerWaalsContact OD1-N 3.13Å; N802-S805 PolarHBondContact OD1-OG 2.93Å; N802-G806 VanDerWaalsContact O-CA 3.31Å; N802-G806 WeakPolarHBondContact O-CA 3.13Å; N802-G806 PolarHBondContact O-N 3.41Å; N802-L807 HydrophobicContact CB-CB 4.48Å; N802-L807 WeakPolarHBondContact CB-O 3.28Å; N802-L807 PolarHBondContact N-O 3.21Å
803	T	84.1	Confident	87.2	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.006	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.3	-177.9	51.5	0	0	0	0	112.9	P748 L755 V801 H1117 F1120	P748-T803 PolarHBondContact O-N 2.92Å; L755-T803 HydrophobicContact CD1-CG2 4.36Å; L755-T803 HydrophobicContact CD2-CG2 4.14Å; V801-T803 PolarHBondContact O-N 2.64Å; T803-H1117 CarbonylContact O-C 3.45Å; T803-H1117 VanDerWaalsContact O-CB 3.3Å; T803-H1117 WeakPolarHBondContact O-CB 3.39Å; T803-F1120 HydrophobicContact CG2-CD2 3.8Å; T803-F1120 HydrophobicContact CG2-CE2 4.34Å; T803-F1120 HydrophobicContact CG2-CG 4.39Å
804	Y	80.8	Confident	86.1	Confident	104 Å²	104	23.8 Å²	23.8	41%	0.408	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-41.3	178.6	-59.8	-92.6	0	0	0	112.2	P748 N802 R1015	P748-Y804 HydrophobicContact CB-CD2 4.01Å; P748-Y804 HydrophobicContact CB-CE2 3.86Å; P748-Y804 HydrophobicContact CG-CD2 4Å; P748-Y804 HydrophobicContact CG-CE2 4.36Å; N802-Y804 PolarHBondContact O-N 3.11Å; N802-Y804 WeakPolarHBondContact OD1-CA 3.26Å; N802-Y804 VanDerWaalsContact OD1-CB 3.3Å; N802-Y804 WeakPolarHBondContact OD1-CB 3.45Å; N802-Y804 PolarHBondContact OD1-N 3.05Å; Y804-R1015 PolarHBondContact O-NH2 3.37Å; Y804-R1015 VanDerWaalsContact O-NH2 3.08Å
805	S	82.8	Confident	84.5	Confident	52 Å²	52	23.8 Å²	23.8	36%	0.364	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-18.4	-177.6	62.8	0	0	0	0	114.1	N802 L807	N802-S805 WeakPolarHBondContact CB-OG 3.12Å; N802-S805 PolarHBondContact ND2-OG 2.82Å; N802-S805 PolarHBondContact O-N 2.88Å; N802-S805 PolarHBondContact OD1-N 3.03Å; N802-S805 VanDerWaalsContact OD1-N 3.13Å; N802-S805 PolarHBondContact OD1-OG 2.93Å; S805-L807 VanDerWaalsContact C-N 3.26Å; S805-L807 WeakPolarHBondContact OG-CB 2.98Å; S805-L807 WeakPolarHBondContact OG-CG 3.12Å; S805-L807 PolarHBondContact OG-N 2.93Å
806	G	84.9	Confident	82.7	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.			trans	80.2	1.3	-170.8	0	0	0	0	0	114	Y772 Y773 Q776 N802	Y772-G806 VanDerWaalsContact CE1-O 3.28Å; Y772-G806 WeakPolarHBondContact CE1-O 3.5Å; Y773-G806 WeakPolarHBondContact CE1-O 3.4Å; Q776-G806 PolarHBondContact NE2-O 3.1Å; N802-G806 VanDerWaalsContact O-CA 3.31Å; N802-G806 WeakPolarHBondContact O-CA 3.13Å; N802-G806 PolarHBondContact O-N 3.41Å
807	L	91.6	Very high	81.1	Confident	61 Å²	61	27.3 Å²	27.3	32%	0.319	14%	0.141	S	C	.	.			trans	-75.3	131.4	-179.9	-66.1	174.6	0	0	0	111.2	T723 Q776 N802 S805	T723-L807 HydrophobicContact CG2-CD1 4.16Å; T723-L807 HydrophobicContact CG2-CD2 4.16Å; Q776-L807 VanDerWaalsContact OE1-CA 3.26Å; N802-L807 HydrophobicContact CB-CB 4.48Å; N802-L807 WeakPolarHBondContact CB-O 3.28Å; N802-L807 PolarHBondContact N-O 3.21Å; S805-L807 VanDerWaalsContact C-N 3.26Å; S805-L807 WeakPolarHBondContact OG-CB 2.98Å; S805-L807 WeakPolarHBondContact OG-CG 3.12Å; S805-L807 PolarHBondContact OG-N 2.93Å
808	C	93.3	Very high	79.7	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142	169.5	73.1	0	0	0	0	112.1	N724 Y773 Q776 V799 L800 V801	N724-C808 WeakPolarHBondContact CA-O 3.39Å; N724-C808 WeakPolarHBondContact CB-O 3.38Å; N724-C808 PolarHBondContact ND2-O 3.47Å; Y773-C808 HydrophobicContact CD1-CB 4.07Å; Q776-C808 WeakPolarHBondContact CB-SG 3.46Å; V799-C808 HydrophobicContact CG1-CB 3.89Å; L800-C808 CarbonylContact O-C 3.35Å; L800-C808 WeakPolarHBondContact O-CA 3.18Å; V801-C808 HydrophobicContact CG2-CB 3.95Å
809	K	93.8	Very high	78.2	Confident	36 Å²	36	24 Å²	24	16%	0.157	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	135.5	-178.8	-59	-163.3	172.4	-159.6	0	111.2	T723 N724 V726 E745 V747 L800	T723-K809 VanDerWaalsContact O-CE 3.23Å; T723-K809 WeakPolarHBondContact O-CE 3.25Å; T723-K809 WeakPolarHBondContact O-CG 3.37Å; N724-K809 WeakPolarHBondContact O-CA 3.44Å; V726-K809 HydrophobicContact CG2-CB 3.4Å; V726-K809 VanDerWaalsContact CG2-CB 3.4Å; V726-K809 HydrophobicContact CG2-CD 4.08Å; V726-K809 HydrophobicContact CG2-CG 4.38Å; E745-K809 WeakPolarHBondContact OE1-CD 3.48Å; E745-K809 IonicContact OE1-NZ 2.71Å; E745-K809 PolarHBondContact OE1-NZ 3.08Å; E745-K809 IonicContact OE2-NZ 3.12Å; E745-K809 PolarHBondContact OE2-NZ 3.48Å; V747-K809 HydrophobicContact CG2-CB 4.34Å; V747-K809 HydrophobicContact CG2-CD 3.92Å; V747-K809 HydrophobicContact CG2-CG 4.41Å; L800-K809 PolarHBondContact N-O 3.34Å; L800-K809 PolarHBondContact O-N 3.22Å
810	I	92.5	Very high	76.4	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	134.6	177.7	-58.6	173.3	0	0	0	109.8	N724 V726 I777 L781 H791 I794	N724-I810 PolarHBondContact O-N 2.85Å; V726-I810 PolarHBondContact N-O 3.23Å; I777-I810 HydrophobicContact CG2-CD1 4.23Å; L781-I810 HydrophobicContact CG-CD1 4.22Å; H791-I810 WeakPolarHBondContact CD2-CG2 3.47Å; H791-I810 WeakPolarHBondContact NE2-CG2 3.28Å; I794-I810 HydrophobicContact CD1-CD1 4.43Å; I794-I810 HydrophobicContact CD1-CG2 4.08Å
811	V	86.7	Confident	74.6	Confident	10 Å²	10	23.9 Å²	23.9	6%	0.061	13%	0.128	C	C	.	.			trans	-119.1	164.5	177.6	-67.4	0	0	0	0	112.1	V726 M744 H791 N798 L800 F813	V726-V811 HydrophobicContact CB-CG1 3.68Å; V726-V811 HydrophobicContact CG1-CG1 4.14Å; V726-V811 HydrophobicContact CG2-CG1 3.23Å; M744-V811 HydrophobicContact CE-CB 4.36Å; M744-V811 HydrophobicContact CE-CG1 3.99Å; H791-V811 PolarHBondContact CE1-O 3.03Å; H791-V811 PolarHBondContact NE2-O 2.96Å; N798-V811 HydrophobicContact CB-CG2 4.17Å; N798-V811 WeakPolarHBondContact O-CG2 3.18Å; N798-V811 PolarHBondContact O-N 3.25Å; L800-V811 HydrophobicContact CD1-CG1 3.58Å; L800-V811 HydrophobicContact CG-CG1 3.77Å; L800-V811 HydrophobicContact CG-CG2 4.25Å; V811-F813 PolarHBondContact O-N 3.17Å
812	D	76.2	Confident	73	Confident	28 Å²	28	23.9 Å²	23.9	15%	0.15	13%	0.128	C	C	.	.			trans	60.9	37.7	167	-77.5	-16.7	0	0	0	115.1	K697	K697-D812 IonicContact NZ-OD1 3.88Å; K697-D812 PolarHBondContact NZ-OD1 3.37Å; K697-D812 IonicContact NZ-OD2 2.7Å; K697-D812 PolarHBondContact NZ-OD2 3.11Å
813	F	66.9	Low	71.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	135.6	174.5	54.5	-91.4	0	0	0	112.2	H717 L720 I725 Y728 L784 I789 H791 V811 T815	H717-F813 HydrophobicContact CB-CE2 3.76Å; H717-F813 HydrophobicContact CB-CZ 4.35Å; H717-F813 AromaticContact CD2-CE2 3.92Å; H717-F813 AromaticContact CG-CE2 3.57Å; H717-F813 AromaticContact ND1-CE2 3.87Å; L720-F813 HydrophobicContact CD1-CD2 4.4Å; L720-F813 HydrophobicContact CD1-CE2 3.36Å; L720-F813 HydrophobicContact CD1-CZ 3.65Å; I725-F813 HydrophobicContact CG2-CD1 4.27Å; I725-F813 HydrophobicContact CG2-CE1 3.41Å; I725-F813 VanDerWaalsContact CG2-CE1 3.41Å; I725-F813 HydrophobicContact CG2-CZ 3.89Å; Y728-F813 HydrophobicContact CD2-CE1 4.15Å; Y728-F813 AromaticContact CD2-CZ 3.75Å; Y728-F813 HydrophobicContact CD2-CZ 3.75Å; Y728-F813 HydrophobicContact CE2-CD1 4.24Å; Y728-F813 AromaticContact CE2-CE1 3.48Å; Y728-F813 HydrophobicContact CE2-CE1 3.48Å; Y728-F813 VanDerWaalsContact CE2-CE1 3.48Å; Y728-F813 HydrophobicContact CE2-CE2 4.05Å; Y728-F813 AromaticContact CE2-CZ 3.39Å; Y728-F813 HydrophobicContact CE2-CZ 3.39Å; L784-F813 HydrophobicContact CD1-CB 4.42Å; L784-F813 HydrophobicContact CD2-CD2 4.28Å; L784-F813 HydrophobicContact CD2-CE2 4.39Å; L784-F813 HydrophobicContact CD2-CG 4.47Å; I789-F813 HydrophobicContact CG2-CD2 4.31Å; H791-F813 HydrophobicContact CB-CB 4.31Å; H791-F813 VanDerWaalsContact CD2-CB 3.44Å; H791-F813 WeakPolarHBondContact CD2-CB 3.25Å; V811-F813 PolarHBondContact O-N 3.17Å; F813-T815 PolarHBondContact O-N 2.72Å; F813-T815 PolarHBondContact O-OG1 2.98Å
814	G	58.6	Low	70.3	Confident	11 Å²	11	27.2 Å²	27.2	11%	0.113	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	-41.2	177	0	0	0	0	0	116.1	H791 C816	H791-G814 PolarHBondContact O-N 3.33Å; G814-C816 PolarHBondContact O-N 2.96Å
815	T	55.6	Low	68.9	Low	1 Å²	1	26.6 Å²	26.6	1%	0.006	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.2	-168.6	49.6	0	0	0	0	115.6	L710 I714 F813 K817 R818 L819	L710-T815 HydrophobicContact CD1-CG2 4.36Å; I714-T815 HydrophobicContact CG1-CG2 4.05Å; F813-T815 PolarHBondContact O-N 2.72Å; F813-T815 PolarHBondContact O-OG1 2.98Å; T815-K817 PolarHBondContact O-N 3.45Å; T815-R818 PolarHBondContact O-N 2.89Å; T815-R818 VanDerWaalsContact O-N 3.11Å; T815-L819 WeakPolarHBondContact O-CG 3.42Å; T815-L819 PolarHBondContact O-N 2.53Å
816	C	52.9	Low	67	Low	16 Å²	16	28 Å²	28	11%	0.108	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-34	-176.3	-74.5	0	0	0	0	113.5	F679 G814 A820	F679-C816 HydrophobicContact CE2-CB 4.04Å; G814-C816 PolarHBondContact O-N 2.96Å; C816-A820 PolarHBondContact O-N 2.81Å
817	K	54.7	Low	64.9	Low	81 Å²	81	36.4 Å²	36.4	35%	0.352	21%	0.209	S	C	.	.	H	α-helix	trans	-65.8	-41.5	178.6	-172	178.6	178.6	180	0	111.7	T815 G821 Q845	T815-K817 PolarHBondContact O-N 3.45Å; K817-G821 PolarHBondContact O-N 3.24Å; K817-Q845 VanDerWaalsContact CE-OE1 3.29Å
818	R	59.1	Low	62.5	Low	29 Å²	29	37.9 Å²	37.9	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	-78.9	-32.8	-179.9	-71.3	-147.4	163	142	5.5	113.5	D619 P709 L710 E713 T815 A820 G821 L822	D619-R818 IonicContact OD2-CZ 3.96Å; D619-R818 VanDerWaalsContact OD2-CZ 3.24Å; D619-R818 IonicContact OD2-NH1 2.68Å; D619-R818 IonicContact OD2-NH2 3.44Å; D619-R818 PolarHBondContact OD2-NH2 3.11Å; P709-R818 PolarHBondContact O-NH1 3.41Å; L710-R818 HydrophobicContact CB-CB 4.17Å; L710-R818 HydrophobicContact CD1-CB 3.74Å; L710-R818 HydrophobicContact CG-CB 4.5Å; E713-R818 WeakPolarHBondContact OE2-CD 3.24Å; E713-R818 WeakPolarHBondContact OE2-CG 3.23Å; T815-R818 PolarHBondContact O-N 2.89Å; T815-R818 VanDerWaalsContact O-N 3.11Å; R818-A820 VanDerWaalsContact C-N 3.25Å; R818-A820 PolarHBondContact O-N 2.97Å; R818-G821 WeakPolarHBondContact O-CA 3.38Å; R818-G821 PolarHBondContact O-N 3.13Å; R818-L822 PolarHBondContact O-N 3.46Å; R818-L822 VanDerWaalsContact O-N 3.11Å
819	L	57.1	Low	60.1	Low	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.6	-38.8	170.9	-74	175.1	0	0	0	112.2	F679 V699 L710 I742 T815 G821 L822 N823	F679-L819 HydrophobicContact CB-CB 4.1Å; F679-L819 HydrophobicContact CD1-CB 4.37Å; F679-L819 HydrophobicContact CD2-CB 4.01Å; F679-L819 HydrophobicContact CD2-CD1 4.32Å; F679-L819 HydrophobicContact CG-CB 3.89Å; V699-L819 HydrophobicContact CB-CD2 4.31Å; V699-L819 HydrophobicContact CG1-CD2 4.28Å; V699-L819 HydrophobicContact CG2-CD2 3.65Å; L710-L819 HydrophobicContact CD1-CD2 4.32Å; L710-L819 HydrophobicContact CD1-CG 4.27Å; L710-L819 HydrophobicContact CD2-CD2 3.72Å; L710-L819 HydrophobicContact CD2-CG 4.47Å; I742-L819 HydrophobicContact CD1-CD2 4.11Å; T815-L819 WeakPolarHBondContact O-CG 3.42Å; T815-L819 PolarHBondContact O-N 2.53Å; L819-G821 VanDerWaalsContact C-N 3.27Å; L819-G821 PolarHBondContact O-N 3.04Å; L819-L822 HydrophobicContact CD2-CD1 4.38Å; L819-L822 PolarHBondContact O-N 2.98Å; L819-N823 PolarHBondContact O-N 3.21Å
820	A	55.5	Low	57.7	Low	19 Å²	19	43 Å²	43	16%	0.157	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-33.4	172.3	0	0	0	0	0	112.9	F679 C816 R818 L822 N823 T830	F679-A820 HydrophobicContact CD1-CB 4.22Å; F679-A820 HydrophobicContact CE1-CB 3.49Å; F679-A820 VanDerWaalsContact CE1-CB 3.49Å; F679-A820 HydrophobicContact CZ-CB 4.08Å; C816-A820 PolarHBondContact O-N 2.81Å; R818-A820 VanDerWaalsContact C-N 3.25Å; R818-A820 PolarHBondContact O-N 2.97Å; A820-L822 VanDerWaalsContact C-N 3.35Å; A820-N823 CarbonylContact O-C 3.56Å; A820-N823 VanDerWaalsContact O-C 3.25Å; A820-N823 PolarHBondContact O-N 2.95Å; A820-T830 HydrophobicContact CB-CG2 3.2Å
821	G	57	Low	55.8	Low	19 Å²	19	44.1 Å²	44.1	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-39.3	173.5	0	0	0	0	0	112.9	N703 K817 R818 L819	N703-G821 VanDerWaalsContact CB-O 3.28Å; N703-G821 WeakPolarHBondContact CB-O 3.49Å; N703-G821 PolarHBondContact ND2-O 3.41Å; K817-G821 PolarHBondContact O-N 3.24Å; R818-G821 WeakPolarHBondContact O-CA 3.38Å; R818-G821 PolarHBondContact O-N 3.13Å; L819-G821 VanDerWaalsContact C-N 3.27Å; L819-G821 PolarHBondContact O-N 3.04Å
822	L	59.2	Low	54.9	Low	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-38.5	176.8	-73.8	-176.9	0	0	0	113.1	V699 I701 K702 N703 E706 V707 L710 F740 R818 L819 A820	V699-L822 HydrophobicContact CG1-CB 4.15Å; V699-L822 HydrophobicContact CG1-CD1 3.93Å; I701-L822 HydrophobicContact CG1-CD2 4.5Å; I701-L822 HydrophobicContact CG2-CD2 4.27Å; K702-L822 CarbonylContact C-O 3.59Å; K702-L822 WeakPolarHBondContact CA-O 3.28Å; K702-L822 WeakPolarHBondContact CB-O 3.41Å; K702-L822 PolarHBondContact N-O 2.78Å; N703-L822 PolarHBondContact N-O 3.15Å; E706-L822 HydrophobicContact CB-CD2 4.07Å; E706-L822 HydrophobicContact CB-CG 4.48Å; V707-L822 HydrophobicContact CB-CD2 4.17Å; V707-L822 HydrophobicContact CG2-CD2 3.32Å; L710-L822 HydrophobicContact CD2-CD1 3.33Å; L710-L822 HydrophobicContact CD2-CG 4.06Å; F740-L822 HydrophobicContact CB-CD1 3.87Å; F740-L822 HydrophobicContact CD1-CD1 4.16Å; F740-L822 HydrophobicContact CG-CD1 3.93Å; R818-L822 PolarHBondContact O-N 3.46Å; R818-L822 VanDerWaalsContact O-N 3.11Å; L819-L822 HydrophobicContact CD2-CD1 4.38Å; L819-L822 PolarHBondContact O-N 2.98Å; A820-L822 VanDerWaalsContact C-N 3.35Å
823	N	60.9	Low	54.9	Low	21 Å²	21	45.7 Å²	45.7	11%	0.112	27%	0.268	C	S	.	.			trans	-134.9	80.9	-176	-163.7	2.5	0	0	0	111.1	Q700 K702 L819 A820 V825	Q700-N823 WeakPolarHBondContact O-CB 3.39Å; K702-N823 WeakPolarHBondContact CD-OD1 3.28Å; K702-N823 WeakPolarHBondContact CE-OD1 3.2Å; K702-N823 WeakPolarHBondContact CG-OD1 3.41Å; K702-N823 PolarHBondContact NZ-OD1 2.89Å; L819-N823 PolarHBondContact O-N 3.21Å; A820-N823 CarbonylContact O-C 3.56Å; A820-N823 VanDerWaalsContact O-C 3.25Å; A820-N823 PolarHBondContact O-N 2.95Å; N823-V825 HydrophobicContact CB-CG2 4.48Å; N823-V825 PolarHBondContact O-N 2.99Å; N823-V825 WeakPolarHBondContact OD1-CG2 3.31Å
824	P	55.6	Low	55.6	Low	82 Å²	82	46.8 Å²	46.8	53%	0.532	27%	0.273	S	S	.	.			trans	-76.2	67.2	176.3	32.9	-34.8	0	0	0	109.2	T826	P824-T826 PolarHBondContact O-N 3.14Å
825	V	51.5	Low	57	Low	92 Å²	92	46.7 Å²	46.7	56%	0.558	27%	0.269	S	S	*	.	S	Bend	trans	-72.7	-18	171.8	-167	0	0	0	0	110.7	N823	N823-V825 HydrophobicContact CB-CG2 4.48Å; N823-V825 PolarHBondContact O-N 2.99Å; N823-V825 WeakPolarHBondContact OD1-CG2 3.31Å
826	T	42.8	Very low	58.5	Low	80 Å²	80	47.5 Å²	47.5	49%	0.491	27%	0.273	S	S	.	.			trans	-145.8	123.4	-172.8	53.9	0	0	0	0	109.6	P824 T828	P824-T826 PolarHBondContact O-N 3.14Å; T826-T828 WeakPolarHBondContact CB-OG1 3.33Å; T826-T828 HydrophobicContact CG2-CG2 4.48Å; T826-T828 PolarHBondContact O-N 2.87Å; T826-T828 PolarHBondContact OG1-OG1 2.77Å
827	D	41.3	Very low	60.1	Low	178 Å²	178	46.8 Å²	46.8	95%	0.952	27%	0.268	S	S	*	.			trans	-59.7	5.9	160.2	-75.8	-35.3	0	0	0	112.6	F829	D827-F829 PolarHBondContact O-N 2.86Å
828	T	41.5	Very low	61.5	Low	92 Å²	92	43 Å²	43	56%	0.564	25%	0.252	S	S	*	.	S	Bend	trans	-72.5	104.6	177.1	62.3	0	0	0	0	109.3	T826 T830	T826-T828 WeakPolarHBondContact CB-OG1 3.33Å; T826-T828 HydrophobicContact CG2-CG2 4.48Å; T826-T828 PolarHBondContact O-N 2.87Å; T826-T828 PolarHBondContact OG1-OG1 2.77Å; T828-T830 PolarHBondContact O-N 3.04Å
829	F	42.2	Very low	62.6	Low	100 Å²	100	42.5 Å²	42.5	44%	0.439	25%	0.251	S	S	.	.			trans	-19.1	115.2	158.5	-175.9	-91.8	0	0	0	113.3	D827 G831 L833 M836	D827-F829 PolarHBondContact O-N 2.86Å; F829-G831 PolarHBondContact O-N 3.47Å; F829-L833 HydrophobicContact CD1-CD2 3.17Å; F829-L833 HydrophobicContact CE1-CD2 3.47Å; F829-L833 VanDerWaalsContact CE1-CD2 3.47Å; F829-L833 HydrophobicContact CG-CD2 4.22Å; F829-M836 HydrophobicContact CD1-CE 4.2Å; F829-M836 HydrophobicContact CE1-CE 3.07Å; F829-M836 HydrophobicContact CE1-SD 3.3Å; F829-M836 WeakPolarHBondContact CE1-SD 3.36Å; F829-M836 HydrophobicContact CZ-CE 3.35Å; F829-M836 HydrophobicContact CZ-SD 3.36Å; F829-M836 WeakPolarHBondContact CZ-SD 3.42Å
830	T	44.8	Very low	63.6	Low	43 Å²	43	42.9 Å²	42.9	26%	0.264	25%	0.253	S	S	.	.	S	Bend	trans	-77.1	90.2	-171.5	56.5	0	0	0	0	110.4	F679 A820 T828	F679-T830 HydrophobicContact CE1-CG2 4.14Å; F679-T830 HydrophobicContact CZ-CG2 4Å; A820-T830 HydrophobicContact CB-CG2 3.2Å; T828-T830 PolarHBondContact O-N 3.04Å
831	G	52.1	Low	64.6	Low	25 Å²	25	44.2 Å²	44.2	26%	0.258	26%	0.257	S	S	.	.	S	Bend	trans	172.5	152.1	174	0	0	0	0	0	111.2	F829 L833	F829-G831 PolarHBondContact O-N 3.47Å; G831-L833 PolarHBondContact O-N 3.33Å
832	T	67.4	Low	65.3	Low	44 Å²	44	47.2 Å²	47.2	27%	0.27	27%	0.269	S	S	.	.			trans	-76.2	97.2	168.7	-52.6	0	0	0	0	107.9	K795 Q834 Y835	K795-T832 VanDerWaalsContact CD-OG1 3.25Å; K795-T832 WeakPolarHBondContact CD-OG1 3.29Å; K795-T832 WeakPolarHBondContact CE-OG1 3.42Å; K795-T832 PolarHBondContact NZ-OG1 2.83Å; T832-Q834 PolarHBondContact O-N 2.93Å; T832-Y835 HydrophobicContact CG2-CD2 3.51Å; T832-Y835 HydrophobicContact CG2-CE2 3.49Å; T832-Y835 VanDerWaalsContact CG2-CE2 3.49Å; T832-Y835 PolarHBondContact O-N 2.9Å
833	L	75.7	Confident	65.6	Low	26 Å²	26	54 Å²	54	14%	0.136	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-44.8	-32.8	-171.1	-56.7	-170.7	0	0	0	114.9	F829 G831 Y835 M836 P877 Q878 I881	F829-L833 HydrophobicContact CD1-CD2 3.17Å; F829-L833 HydrophobicContact CE1-CD2 3.47Å; F829-L833 VanDerWaalsContact CE1-CD2 3.47Å; F829-L833 HydrophobicContact CG-CD2 4.22Å; G831-L833 PolarHBondContact O-N 3.33Å; L833-Y835 VanDerWaalsContact C-N 3.26Å; L833-Y835 PolarHBondContact O-N 3.02Å; L833-M836 PolarHBondContact O-N 2.77Å; L833-P877 HydrophobicContact CB-CB 3.96Å; L833-P877 HydrophobicContact CD1-CB 4.03Å; L833-P877 HydrophobicContact CG-CB 4.25Å; L833-Q878 HydrophobicContact CD1-CG 4.2Å; L833-I881 HydrophobicContact CB-CD1 3.64Å; L833-I881 HydrophobicContact CB-CG1 3.89Å; L833-I881 HydrophobicContact CD1-CD1 3.59Å; L833-I881 HydrophobicContact CD2-CD1 3.82Å; L833-I881 HydrophobicContact CG-CD1 3.83Å
834	Q	82.9	Confident	65.6	Low	23 Å²	23	54.6 Å²	54.6	11%	0.107	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-69.8	-16.6	-176.5	-60.4	162.7	-22.1	0	0	114.2	T832 P870 P877 A880	T832-Q834 PolarHBondContact O-N 2.93Å; Q834-P870 HydrophobicContact CB-CG 3.95Å; Q834-P870 PolarHBondContact OE1-O 2.97Å; Q834-P877 HydrophobicContact CG-CB 4.12Å; Q834-A880 HydrophobicContact CB-CB 4.39Å; Q834-A880 HydrophobicContact CG-CB 4Å
835	Y	88.2	Confident	65.5	Low	9 Å²	9	53.5 Å²	53.5	4%	0.035	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-96.9	-0.5	-176	-66.5	-107.6	0	0	0	112.7	I794 K795 T832 L833 S856 C859 E863 P870	I794-Y835 WeakPolarHBondContact O-CD1 3.45Å; K795-Y835 HydrophobicContact CB-CD1 3.69Å; K795-Y835 HydrophobicContact CB-CD2 4.43Å; K795-Y835 HydrophobicContact CB-CE1 3.43Å; K795-Y835 VanDerWaalsContact CB-CE1 3.43Å; K795-Y835 HydrophobicContact CB-CE2 4.23Å; K795-Y835 HydrophobicContact CB-CG 4.2Å; T832-Y835 HydrophobicContact CG2-CD2 3.51Å; T832-Y835 HydrophobicContact CG2-CE2 3.49Å; T832-Y835 VanDerWaalsContact CG2-CE2 3.49Å; T832-Y835 PolarHBondContact O-N 2.9Å; L833-Y835 VanDerWaalsContact C-N 3.26Å; L833-Y835 PolarHBondContact O-N 3.02Å; Y835-S856 PolarHBondContact O-OG 3.12Å; Y835-C859 HydrophobicContact CD1-CB 3.48Å; Y835-C859 VanDerWaalsContact CD1-CB 3.48Å; Y835-C859 HydrophobicContact CE1-CB 4.02Å; Y835-C859 HydrophobicContact CG-CB 4.12Å; Y835-E863 VanDerWaalsContact OH-CD 3.25Å; Y835-E863 PolarHBondContact OH-OE2 3.11Å; Y835-P870 HydrophobicContact CD1-CG 4.38Å; Y835-P870 HydrophobicContact CD2-CG 4.09Å; Y835-P870 HydrophobicContact CE1-CG 4.12Å; Y835-P870 HydrophobicContact CE2-CG 3.79Å; Y835-P870 HydrophobicContact CG-CG 4.37Å; Y835-P870 WeakPolarHBondContact OH-CD 3.49Å
836	M	85.9	Confident	65.5	Low	19 Å²	19	51.4 Å²	51.4	9%	0.094	28%	0.281	C	S	.	.			trans	-78.9	138.5	-170.6	-67	-153.1	153.5	0	0	113.6	F829 L833 V840 I841 W855	F829-M836 HydrophobicContact CD1-CE 4.2Å; F829-M836 HydrophobicContact CE1-CE 3.07Å; F829-M836 HydrophobicContact CE1-SD 3.3Å; F829-M836 WeakPolarHBondContact CE1-SD 3.36Å; F829-M836 HydrophobicContact CZ-CE 3.35Å; F829-M836 HydrophobicContact CZ-SD 3.36Å; F829-M836 WeakPolarHBondContact CZ-SD 3.42Å; L833-M836 PolarHBondContact O-N 2.77Å; M836-V840 HydrophobicContact CE-CG1 4.43Å; M836-V840 HydrophobicContact SD-CG1 4.06Å; M836-I841 HydrophobicContact CB-CD1 4.31Å; M836-I841 HydrophobicContact CB-CG1 4.21Å; M836-W855 PolarHBondContact O-NE1 3.26Å
837	A	86.1	Confident	66	Low	1 Å²	1	49.3 Å²	49.3	1%	0.008	28%	0.275	C	S	.	.			trans	-75.9	151.9	174.8	0	0	0	0	0	111.3	E839 V840 I841 A852 W855	A837-E839 VanDerWaalsContact C-N 3.26Å; A837-E839 VanDerWaalsContact CB-CD 3.42Å; A837-E839 HydrophobicContact CB-CG 4.45Å; A837-E839 WeakPolarHBondContact CB-OE1 3.34Å; A837-E839 VanDerWaalsContact CB-OE2 3.31Å; A837-E839 WeakPolarHBondContact CB-OE2 3.38Å; A837-E839 PolarHBondContact O-N 2.9Å; A837-V840 HydrophobicContact CB-CG2 4.09Å; A837-V840 WeakPolarHBondContact O-CB 3.41Å; A837-V840 PolarHBondContact O-N 3.21Å; A837-I841 PolarHBondContact O-N 2.81Å; A837-A852 HydrophobicContact CB-CB 4.23Å; A837-W855 HydrophobicContact CB-CB 3.67Å; A837-W855 HydrophobicContact CB-CD2 4.06Å; A837-W855 HydrophobicContact CB-CG 3.6Å
838	P	84.3	Confident	67.1	Low	2 Å²	2	41.8 Å²	41.8	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-56.1	-37.5	-178.4	-20.9	27.8	0	0	0	114	V840 I841 D842 W855 V884 K888	P838-V840 VanDerWaalsContact C-N 3.29Å; P838-V840 PolarHBondContact O-N 3.14Å; P838-I841 PolarHBondContact O-N 3.32Å; P838-D842 VanDerWaalsContact O-CG 3.26Å; P838-D842 PolarHBondContact O-N 3.46Å; P838-W855 HydrophobicContact CG-CE3 4.39Å; P838-W855 HydrophobicContact CG-CH2 3.74Å; P838-W855 HydrophobicContact CG-CZ2 4.19Å; P838-W855 HydrophobicContact CG-CZ3 3.85Å; P838-V884 HydrophobicContact CB-CG1 4.2Å; P838-V884 HydrophobicContact CG-CG1 3.73Å; P838-K888 HydrophobicContact CB-CD 3.55Å; P838-K888 HydrophobicContact CG-CD 4.19Å
839	E	82.5	Confident	68.7	Low	17 Å²	17	38.6 Å²	38.6	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-67.6	-27.4	179.6	66.4	-85.6	-162.9	0	0	113.6	A837 I841 H843 P913 R916	A837-E839 VanDerWaalsContact C-N 3.26Å; A837-E839 VanDerWaalsContact CB-CD 3.42Å; A837-E839 HydrophobicContact CB-CG 4.45Å; A837-E839 WeakPolarHBondContact CB-OE1 3.34Å; A837-E839 VanDerWaalsContact CB-OE2 3.31Å; A837-E839 WeakPolarHBondContact CB-OE2 3.38Å; A837-E839 PolarHBondContact O-N 2.9Å; E839-I841 VanDerWaalsContact C-N 3.34Å; E839-H843 PolarHBondContact O-N 2.98Å; E839-H843 VanDerWaalsContact O-N 3.16Å; E839-P913 HydrophobicContact CB-CG 4.41Å; E839-P913 HydrophobicContact CG-CB 4.42Å; E839-P913 HydrophobicContact CG-CG 4.36Å; E839-R916 IonicContact OE1-CZ 3.51Å; E839-R916 IonicContact OE1-NH1 3.28Å; E839-R916 PolarHBondContact OE1-NH1 2.79Å; E839-R916 IonicContact OE1-NH2 3.85Å; E839-R916 PolarHBondContact OE1-NH2 3.07Å; E839-R916 IonicContact OE2-CZ 3.69Å; E839-R916 IonicContact OE2-NH1 2.64Å; E839-R916 IonicContact OE2-NH2 2.73Å; E839-R916 PolarHBondContact OE2-NH2 2.58Å
840	V	79	Confident	70.8	Confident	8 Å²	8	35.4 Å²	35.4	5%	0.048	21%	0.211	C	C	.	.	H	α-helix	trans	-72.5	-34.4	175.2	-175	0	0	0	0	110.1	M836 A837 P838 G844 Y848 A852	M836-V840 HydrophobicContact CE-CG1 4.43Å; M836-V840 HydrophobicContact SD-CG1 4.06Å; A837-V840 HydrophobicContact CB-CG2 4.09Å; A837-V840 WeakPolarHBondContact O-CB 3.41Å; A837-V840 PolarHBondContact O-N 3.21Å; P838-V840 VanDerWaalsContact C-N 3.29Å; P838-V840 PolarHBondContact O-N 3.14Å; V840-G844 CarbonylContact O-C 3.58Å; V840-G844 WeakPolarHBondContact O-CA 3.43Å; V840-G844 PolarHBondContact O-N 2.85Å; V840-Y848 HydrophobicContact CB-CD1 4.37Å; V840-Y848 HydrophobicContact CG1-CD1 4.03Å; V840-Y848 HydrophobicContact CG1-CE1 3.89Å; V840-Y848 HydrophobicContact CG2-CD1 3.9Å; V840-Y848 HydrophobicContact CG2-CD2 3.75Å; V840-Y848 HydrophobicContact CG2-CE1 4.31Å; V840-Y848 HydrophobicContact CG2-CE2 4.11Å; V840-Y848 HydrophobicContact CG2-CG 3.6Å; V840-A852 HydrophobicContact CG2-CB 3.93Å
841	I	76	Confident	72.9	Confident	47 Å²	47	35.2 Å²	35.2	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-73.9	-42.7	178.1	-62.2	167.8	0	0	0	110.5	M836 A837 P838 E839 I881 V884	M836-I841 HydrophobicContact CB-CD1 4.31Å; M836-I841 HydrophobicContact CB-CG1 4.21Å; A837-I841 PolarHBondContact O-N 2.81Å; P838-I841 PolarHBondContact O-N 3.32Å; E839-I841 VanDerWaalsContact C-N 3.34Å; I841-I881 HydrophobicContact CD1-CB 4.49Å; I841-I881 HydrophobicContact CD1-CG2 4.11Å; I841-I881 HydrophobicContact CG1-CG2 4.27Å; I841-I881 HydrophobicContact CG2-CG2 3.82Å; I841-V884 HydrophobicContact CD1-CB 3.85Å; I841-V884 HydrophobicContact CD1-CG1 3.76Å
842	D	72.6	Confident	74.6	Confident	83 Å²	83	34.2 Å²	34.2	44%	0.444	20%	0.199	S	C	.	.	H	α-helix	trans	-74.6	-40.4	-175.2	-65.7	-23.1	0	0	0	113.8	P838 K888	P838-D842 VanDerWaalsContact O-CG 3.26Å; P838-D842 PolarHBondContact O-N 3.46Å; D842-K888 IonicContact OD1-NZ 3.02Å; D842-K888 PolarHBondContact OD1-NZ 3.39Å; D842-K888 IonicContact OD2-NZ 2.74Å; D842-K888 PolarHBondContact OD2-NZ 3.17Å
843	H	64.4	Low	75.7	Confident	143 Å²	143	32.1 Å²	32.1	66%	0.662	19%	0.186	S	C	*	.	H	α-helix	trans	-107.2	-1.7	-171.7	-59.9	-53	0	0	0	113.6	E839	E839-H843 PolarHBondContact O-N 2.98Å; E839-H843 VanDerWaalsContact O-N 3.16Å
844	G	60.6	Low	76.6	Confident	32 Å²	32	30.9 Å²	30.9	33%	0.33	18%	0.18	S	C	.	.			trans	74.9	-165.5	-176.3	0	0	0	0	0	112.9	V840 R846	V840-G844 CarbonylContact O-C 3.58Å; V840-G844 WeakPolarHBondContact O-CA 3.43Å; V840-G844 PolarHBondContact O-N 2.85Å; G844-R846 VanDerWaalsContact C-N 3.27Å; G844-R846 PolarHBondContact O-N 2.98Å
845	Q	53.9	Low	77.2	Confident	60 Å²	60	29.8 Å²	29.8	28%	0.28	18%	0.175	S	C	.	.	S	Bend	trans	-73.4	-13.1	-172.7	-71.1	-171.1	-17.7	0	0	114.8	K817 Y848	K817-Q845 VanDerWaalsContact CE-OE1 3.29Å; Q845-Y848 VanDerWaalsContact O-CE1 3.25Å; Q845-Y848 WeakPolarHBondContact O-CE1 3.43Å
846	R	51.6	Low	77.4	Confident	48 Å²	48	29.8 Å²	29.8	18%	0.181	18%	0.176	C	C	.	.	S	Bend	trans	-95.5	132.6	177.5	-79.6	-168.8	159.7	161.2	-0.5	110.5	E553 P554 D618 G844	E553-R846 IonicContact OE2-CZ 3.34Å; E553-R846 IonicContact OE2-NH1 3.79Å; E553-R846 PolarHBondContact OE2-NH1 2.91Å; E553-R846 IonicContact OE2-NH2 2.9Å; P554-R846 VanDerWaalsContact CD-CZ 3.49Å; P554-R846 VanDerWaalsContact CD-NH2 3.3Å; D618-R846 WeakPolarHBondContact OD1-CG 3.33Å; D618-R846 IonicContact OD1-NE 2.64Å; D618-R846 PolarHBondContact OD1-NE 3.07Å; D618-R846 VanDerWaalsContact OD1-NE 3.11Å; G844-R846 VanDerWaalsContact C-N 3.27Å; G844-R846 PolarHBondContact O-N 2.98Å
847	G	52.4	Low	77.8	Confident	36 Å²	36	28.9 Å²	28.9	37%	0.371	17%	0.172	S	C	.	.	S	Bend	trans	94.7	6	169.3	0	0	0	0	0	117
848	Y	64.7	Low	78.3	Confident	20 Å²	20	28.8 Å²	28.8	8%	0.078	17%	0.171	C	C	.	.			trans	-94.5	143.3	167.8	73.9	-91.8	0	0	0	111.2	R792 V840 Q845 A852	R792-Y848 HydrophobicContact CB-CE2 4.23Å; R792-Y848 VanDerWaalsContact CB-OH 3.3Å; R792-Y848 WeakPolarHBondContact CB-OH 3.34Å; R792-Y848 WeakPolarHBondContact CD-OH 3.46Å; R792-Y848 HydrophobicContact CG-CE2 3.77Å; R792-Y848 VanDerWaalsContact CG-OH 3.3Å; R792-Y848 WeakPolarHBondContact CG-OH 3.38Å; V840-Y848 HydrophobicContact CB-CD1 4.37Å; V840-Y848 HydrophobicContact CG1-CD1 4.03Å; V840-Y848 HydrophobicContact CG1-CE1 3.89Å; V840-Y848 HydrophobicContact CG2-CD1 3.9Å; V840-Y848 HydrophobicContact CG2-CD2 3.75Å; V840-Y848 HydrophobicContact CG2-CE1 4.31Å; V840-Y848 HydrophobicContact CG2-CE2 4.11Å; V840-Y848 HydrophobicContact CG2-CG 3.6Å; Q845-Y848 VanDerWaalsContact O-CE1 3.25Å; Q845-Y848 WeakPolarHBondContact O-CE1 3.43Å; Y848-A852 HydrophobicContact CD2-CB 3.43Å; Y848-A852 VanDerWaalsContact CD2-CB 3.43Å; Y848-A852 HydrophobicContact CE2-CB 4.01Å; Y848-A852 HydrophobicContact CG-CB 4.32Å
849	G	75.1	Confident	78.8	Confident	25 Å²	25	28.7 Å²	28.7	26%	0.258	17%	0.171	S	C	.	.			trans	-118	-162.7	-174.3	0	0	0	0	0	113.9	P851 A852	G849-P851 WeakPolarHBondContact O-CD 3.34Å; G849-A852 WeakPolarHBondContact O-CB 3.35Å; G849-A852 PolarHBondContact O-N 2.98Å
850	A	85.7	Confident	79.3	Confident	32 Å²	32	27.9 Å²	27.9	26%	0.264	17%	0.167	S	C	.	.	H	α-helix	trans	-43.8	-34.1	175.2	0	0	0	0	0	116.1	H785 A852 D853	H785-A850 HydrophobicContact CB-CB 4.34Å; H785-A850 PolarHBondContact CE1-O 2.76Å; H785-A850 VanDerWaalsContact CE1-O 3.28Å; A850-A852 PolarHBondContact O-N 2.79Å; A850-D853 PolarHBondContact O-N 3.19Å
851	P	89.7	Confident	80.1	Confident	40 Å²	40	27.5 Å²	27.5	26%	0.26	17%	0.165	S	C	.	.	H	α-helix	trans	-59.3	-29.5	175.4	-27.5	36.9	0	0	0	114.4	G849 D853 V854 W855 P913 R916	G849-P851 WeakPolarHBondContact O-CD 3.34Å; P851-D853 VanDerWaalsContact C-N 3.34Å; P851-D853 PolarHBondContact O-N 2.9Å; P851-V854 WeakPolarHBondContact O-CB 3.49Å; P851-V854 PolarHBondContact O-N 3.38Å; P851-W855 PolarHBondContact O-N 2.75Å; P851-P913 HydrophobicContact CB-CB 3.93Å; P851-P913 HydrophobicContact CG-CB 4.36Å; P851-R916 VanDerWaalsContact C-NH1 3.26Å; P851-R916 HydrophobicContact CB-CB 4.46Å; P851-R916 WeakPolarHBondContact O-CD 3.44Å; P851-R916 PolarHBondContact O-NH1 2.69Å
852	A	87.9	Confident	80.9	Confident	3 Å²	3	25.5 Å²	25.5	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-38.5	179.3	0	0	0	0	0	111.7	A837 V840 Y848 G849 A850 V854 W855 S856	A837-A852 HydrophobicContact CB-CB 4.23Å; V840-A852 HydrophobicContact CG2-CB 3.93Å; Y848-A852 HydrophobicContact CD2-CB 3.43Å; Y848-A852 VanDerWaalsContact CD2-CB 3.43Å; Y848-A852 HydrophobicContact CE2-CB 4.01Å; Y848-A852 HydrophobicContact CG-CB 4.32Å; G849-A852 WeakPolarHBondContact O-CB 3.35Å; G849-A852 PolarHBondContact O-N 2.98Å; A850-A852 PolarHBondContact O-N 2.79Å; A852-V854 PolarHBondContact O-N 2.57Å; A852-W855 WeakPolarHBondContact O-CB 3.44Å; A852-W855 PolarHBondContact O-N 2.98Å; A852-W855 VanDerWaalsContact O-N 3.1Å; A852-S856 PolarHBondContact O-N 3.21Å; A852-S856 VanDerWaalsContact O-N 3.09Å; A852-S856 PolarHBondContact O-OG 3.24Å
853	D	90.8	Very high	81.9	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-33.1	174.8	-67.9	-22.9	0	0	0	111.6	L781 H785 V790 H791 R792 I794 A850 P851 S856 F857	L781-D853 HydrophobicContact CD2-CB 3.95Å; H785-D853 IonicContact CD2-OD2 2.84Å; H785-D853 IonicContact CE1-OD2 2.73Å; H785-D853 IonicContact NE2-OD2 3.4Å; H785-D853 PolarHBondContact NE2-OD2 2.81Å; V790-D853 WeakPolarHBondContact CA-OD2 3.32Å; V790-D853 WeakPolarHBondContact CG1-OD2 3Å; H791-D853 PolarHBondContact N-OD1 3.36Å; H791-D853 PolarHBondContact N-OD2 3.24Å; R792-D853 PolarHBondContact N-OD1 3.05Å; I794-D853 HydrophobicContact CG1-CB 4.29Å; A850-D853 PolarHBondContact O-N 3.19Å; P851-D853 VanDerWaalsContact C-N 3.34Å; P851-D853 PolarHBondContact O-N 2.9Å; D853-S856 PolarHBondContact O-N 2.97Å; D853-F857 VanDerWaalsContact O-CB 3.31Å; D853-F857 WeakPolarHBondContact O-CB 3.29Å; D853-F857 PolarHBondContact O-N 3.4Å
854	V	94.6	Very high	83.3	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.8	-36.2	177.1	178.3	0	0	0	0	111.4	P851 A852 F857 G858 C908 R916 L922	P851-V854 WeakPolarHBondContact O-CB 3.49Å; P851-V854 PolarHBondContact O-N 3.38Å; A852-V854 PolarHBondContact O-N 2.57Å; V854-F857 PolarHBondContact O-N 2.8Å; V854-G858 PolarHBondContact O-N 3.42Å; V854-C908 HydrophobicContact CG1-CB 4.22Å; V854-R916 HydrophobicContact CB-CG 4.36Å; V854-R916 HydrophobicContact CG1-CG 4Å; V854-L922 HydrophobicContact CG1-CD1 3.53Å
855	W	94.3	Very high	84.8	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65.6	-45	172.9	177.4	-77.1	0	0	0	111.4	M836 A837 P838 P851 A852 F857 G858 C859 V884 H890 F909	M836-W855 PolarHBondContact O-NE1 3.26Å; A837-W855 HydrophobicContact CB-CB 3.67Å; A837-W855 HydrophobicContact CB-CD2 4.06Å; A837-W855 HydrophobicContact CB-CG 3.6Å; P838-W855 HydrophobicContact CG-CE3 4.39Å; P838-W855 HydrophobicContact CG-CH2 3.74Å; P838-W855 HydrophobicContact CG-CZ2 4.19Å; P838-W855 HydrophobicContact CG-CZ3 3.85Å; P851-W855 PolarHBondContact O-N 2.75Å; A852-W855 WeakPolarHBondContact O-CB 3.44Å; A852-W855 PolarHBondContact O-N 2.98Å; A852-W855 VanDerWaalsContact O-N 3.1Å; W855-F857 VanDerWaalsContact C-N 3.32Å; W855-F857 PolarHBondContact O-N 2.85Å; W855-G858 WeakPolarHBondContact O-CA 3.33Å; W855-G858 PolarHBondContact O-N 3.31Å; W855-G858 VanDerWaalsContact O-N 3.11Å; W855-C859 PolarHBondContact O-N 2.82Å; W855-C859 PolarHBondContact O-SG 3.04Å; W855-C859 VanDerWaalsContact O-SG 3.4Å; W855-V884 HydrophobicContact CH2-CG1 4.34Å; W855-V884 HydrophobicContact CZ2-CG1 3.77Å; W855-V884 HydrophobicContact CZ2-CG2 4.42Å; W855-H890 HydrophobicContact CH2-CB 4.06Å; W855-H890 HydrophobicContact CZ2-CB 4.38Å; W855-F909 AromaticContact CD2-CD1 3.75Å; W855-F909 HydrophobicContact CD2-CD1 3.75Å; W855-F909 HydrophobicContact CD2-CE1 4.29Å; W855-F909 AromaticContact CE2-CD1 3.9Å; W855-F909 HydrophobicContact CE3-CB 4.36Å; W855-F909 AromaticContact CE3-CD1 3.83Å; W855-F909 HydrophobicContact CE3-CD1 3.83Å; W855-F909 HydrophobicContact CG-CD1 4.29Å; W855-F909 HydrophobicContact CG-CE1 4.5Å; W855-F909 HydrophobicContact CH2-CB 4.49Å; W855-F909 HydrophobicContact CH2-CD1 4.2Å; W855-F909 HydrophobicContact CZ2-CD1 4.14Å; W855-F909 HydrophobicContact CZ3-CB 4.05Å; W855-F909 HydrophobicContact CZ3-CD1 4.05Å; W855-F909 WeakPolarHBondContact CZ3-O 3.24Å
856	S	92.6	Very high	86.5	Confident	9 Å²	9	12.9 Å²	12.9	6%	0.063	9%	0.087	C	C	.	.	H	α-helix	trans	-66.2	-33.2	177.7	-57.9	0	0	0	0	112.2	I794 Y835 A852 D853 C859 T860	I794-S856 WeakPolarHBondContact O-CB 3.47Å; Y835-S856 PolarHBondContact O-OG 3.12Å; A852-S856 PolarHBondContact O-N 3.21Å; A852-S856 VanDerWaalsContact O-N 3.09Å; A852-S856 PolarHBondContact O-OG 3.24Å; D853-S856 PolarHBondContact O-N 2.97Å; S856-C859 WeakPolarHBondContact O-CB 3.28Å; S856-C859 PolarHBondContact O-N 3.08Å; S856-T860 PolarHBondContact O-N 3.27Å; S856-T860 PolarHBondContact O-OG1 2.91Å
857	F	95.9	Very high	88.3	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.6	-44.5	167.4	170.9	-102.5	0	0	0	112	A774 I777 L778 L781 I794 D853 V854 W855 C859 T860 M861 F904	A774-F857 HydrophobicContact CB-CE2 4.41Å; A774-F857 HydrophobicContact CB-CZ 4Å; I777-F857 HydrophobicContact CB-CD2 4.27Å; I777-F857 HydrophobicContact CB-CE2 4.01Å; I777-F857 HydrophobicContact CG2-CD2 3.64Å; I777-F857 HydrophobicContact CG2-CE2 3.9Å; L778-F857 HydrophobicContact CD1-CE1 3.94Å; L778-F857 HydrophobicContact CD1-CZ 3.82Å; L778-F857 HydrophobicContact CD2-CD1 3.9Å; L778-F857 HydrophobicContact CD2-CD2 4.38Å; L778-F857 HydrophobicContact CD2-CE1 3.77Å; L778-F857 HydrophobicContact CD2-CE2 4.26Å; L778-F857 HydrophobicContact CD2-CG 4.2Å; L778-F857 HydrophobicContact CD2-CZ 3.95Å; L778-F857 HydrophobicContact CG-CD1 4.43Å; L778-F857 HydrophobicContact CG-CE1 3.85Å; L778-F857 HydrophobicContact CG-CE2 3.92Å; L778-F857 HydrophobicContact CG-CZ 3.55Å; L781-F857 HydrophobicContact CD1-CB 4.06Å; L781-F857 HydrophobicContact CD1-CD2 4.45Å; L781-F857 HydrophobicContact CD1-CG 4.42Å; I794-F857 HydrophobicContact CG2-CB 4.34Å; D853-F857 VanDerWaalsContact O-CB 3.31Å; D853-F857 WeakPolarHBondContact O-CB 3.29Å; D853-F857 PolarHBondContact O-N 3.4Å; V854-F857 PolarHBondContact O-N 2.8Å; W855-F857 VanDerWaalsContact C-N 3.32Å; W855-F857 PolarHBondContact O-N 2.85Å; F857-C859 VanDerWaalsContact C-N 3.26Å; F857-C859 PolarHBondContact O-N 3.27Å; F857-T860 CarbonylContact O-C 3.55Å; F857-T860 WeakPolarHBondContact O-CA 3.3Å; F857-T860 WeakPolarHBondContact O-CB 3.11Å; F857-T860 PolarHBondContact O-N 2.84Å; F857-M861 HydrophobicContact CD1-CG 4.49Å; F857-M861 HydrophobicContact CE1-CG 3.98Å; F857-M861 HydrophobicContact CE1-SD 4.4Å; F857-M861 HydrophobicContact CE2-CG 4.37Å; F857-M861 HydrophobicContact CE2-SD 4.25Å; F857-M861 HydrophobicContact CZ-CG 3.92Å; F857-M861 HydrophobicContact CZ-SD 3.81Å; F857-M861 PolarHBondContact O-N 3Å; F857-F904 AromaticContact CE1-CE1 3.83Å; F857-F904 HydrophobicContact CE1-CE1 3.83Å; F857-F904 AromaticContact CE1-CZ 3.82Å; F857-F904 HydrophobicContact CE1-CZ 3.82Å; F857-F904 HydrophobicContact CZ-CE1 4.11Å; F857-F904 HydrophobicContact CZ-CZ 4.12Å
858	G	95.2	Very high	90	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-56.4	-40.8	172.5	0	0	0	0	0	112.5	V854 W855 T860 M861 I862	V854-G858 PolarHBondContact O-N 3.42Å; W855-G858 WeakPolarHBondContact O-CA 3.33Å; W855-G858 PolarHBondContact O-N 3.31Å; W855-G858 VanDerWaalsContact O-N 3.11Å; G858-T860 VanDerWaalsContact C-N 3.34Å; G858-T860 PolarHBondContact O-N 2.97Å; G858-M861 WeakPolarHBondContact O-CB 3.36Å; G858-M861 PolarHBondContact O-N 2.88Å; G858-I862 PolarHBondContact O-N 3.49Å
859	C	94.6	Very high	91	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.9	-39.2	173.3	-65.3	0	0	0	0	112.3	Y835 W855 S856 F857 M861 I862 E863 P870	Y835-C859 HydrophobicContact CD1-CB 3.48Å; Y835-C859 VanDerWaalsContact CD1-CB 3.48Å; Y835-C859 HydrophobicContact CE1-CB 4.02Å; Y835-C859 HydrophobicContact CG-CB 4.12Å; W855-C859 PolarHBondContact O-N 2.82Å; W855-C859 PolarHBondContact O-SG 3.04Å; W855-C859 VanDerWaalsContact O-SG 3.4Å; S856-C859 WeakPolarHBondContact O-CB 3.28Å; S856-C859 PolarHBondContact O-N 3.08Å; F857-C859 VanDerWaalsContact C-N 3.26Å; F857-C859 PolarHBondContact O-N 3.27Å; C859-M861 VanDerWaalsContact C-N 3.32Å; C859-M861 PolarHBondContact O-N 2.8Å; C859-I862 WeakPolarHBondContact O-CB 3.18Å; C859-I862 PolarHBondContact O-N 3.28Å; C859-E863 PolarHBondContact O-N 3.23Å; C859-P870 HydrophobicContact CB-CB 4.43Å; C859-P870 HydrophobicContact CB-CG 4.09Å
860	T	94.6	Very high	91.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.7	-32.1	176.1	-53.3	0	0	0	0	112.1	L752 K795 S856 F857 G858 E863 M864	L752-T860 HydrophobicContact CD2-CG2 4.11Å; K795-T860 WeakPolarHBondContact CA-OG1 3.11Å; S856-T860 PolarHBondContact O-N 3.27Å; S856-T860 PolarHBondContact O-OG1 2.91Å; F857-T860 CarbonylContact O-C 3.55Å; F857-T860 WeakPolarHBondContact O-CA 3.3Å; F857-T860 WeakPolarHBondContact O-CB 3.11Å; F857-T860 PolarHBondContact O-N 2.84Å; G858-T860 VanDerWaalsContact C-N 3.34Å; G858-T860 PolarHBondContact O-N 2.97Å; T860-E863 WeakPolarHBondContact O-CB 3.44Å; T860-E863 PolarHBondContact O-N 3.2Å; T860-M864 PolarHBondContact O-N 2.77Å
861	M	95.2	Very high	91.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.7	-41.1	172.2	-70.2	-65.9	-61.2	0	0	112.3	M770 A774 F857 G858 C859 E863 M864 A865 F904 I905 F927	M770-M861 HydrophobicContact CE-CE 3.86Å; A774-M861 HydrophobicContact CB-CE 4.12Å; A774-M861 HydrophobicContact CB-SD 3.53Å; A774-M861 VanDerWaalsContact CB-SD 3.53Å; F857-M861 HydrophobicContact CD1-CG 4.49Å; F857-M861 HydrophobicContact CE1-CG 3.98Å; F857-M861 HydrophobicContact CE1-SD 4.4Å; F857-M861 HydrophobicContact CE2-CG 4.37Å; F857-M861 HydrophobicContact CE2-SD 4.25Å; F857-M861 HydrophobicContact CZ-CG 3.92Å; F857-M861 HydrophobicContact CZ-SD 3.81Å; F857-M861 PolarHBondContact O-N 3Å; G858-M861 WeakPolarHBondContact O-CB 3.36Å; G858-M861 PolarHBondContact O-N 2.88Å; C859-M861 VanDerWaalsContact C-N 3.32Å; C859-M861 PolarHBondContact O-N 2.8Å; M861-E863 VanDerWaalsContact C-N 3.29Å; M861-M864 HydrophobicContact CE-CE 4.31Å; M861-M864 HydrophobicContact CG-CE 4.35Å; M861-M864 PolarHBondContact O-N 2.75Å; M861-M864 HydrophobicContact SD-CE 3.25Å; M861-M864 WeakPolarHBondContact SD-CE 3.36Å; M861-A865 PolarHBondContact O-N 2.85Å; M861-F904 HydrophobicContact CE-CD1 4.14Å; M861-F904 HydrophobicContact CE-CE1 3.96Å; M861-F904 HydrophobicContact CG-CE1 4.37Å; M861-F904 HydrophobicContact SD-CE1 4.2Å; M861-I905 HydrophobicContact CB-CD1 4Å; M861-I905 HydrophobicContact CB-CG1 3.86Å; M861-I905 HydrophobicContact CE-CG1 4.35Å; M861-I905 HydrophobicContact CG-CG1 4.37Å; M861-F927 HydrophobicContact CE-CE1 3.95Å; M861-F927 HydrophobicContact CE-CZ 4.27Å
862	I	93.5	Very high	90.9	Very high	5 Å²	5	16 Å²	16	3%	0.026	9%	0.091	C	C	.	.	H	α-helix	trans	-63.7	-39.6	174.2	-61.9	-64.4	0	0	0	110.6	G858 C859 A865 T866 P891 I893 I905 F909	G858-I862 PolarHBondContact O-N 3.49Å; C859-I862 WeakPolarHBondContact O-CB 3.18Å; C859-I862 PolarHBondContact O-N 3.28Å; I862-A865 PolarHBondContact O-N 2.86Å; I862-T866 HydrophobicContact CG2-CG2 4.31Å; I862-T866 WeakPolarHBondContact O-CB 3.33Å; I862-T866 WeakPolarHBondContact O-CG2 3.46Å; I862-T866 PolarHBondContact O-N 2.79Å; I862-T866 PolarHBondContact O-OG1 2.9Å; I862-P891 HydrophobicContact CG1-CB 4.42Å; I862-P891 HydrophobicContact CG2-CB 4.5Å; I862-I893 HydrophobicContact CD1-CB 4.29Å; I862-I893 HydrophobicContact CD1-CG1 4.1Å; I862-I893 HydrophobicContact CD1-CG2 4.3Å; I862-I905 HydrophobicContact CD1-CD1 4.36Å; I862-I905 HydrophobicContact CD1-CG2 3.9Å; I862-I905 HydrophobicContact CG1-CG2 4.31Å; I862-F909 HydrophobicContact CG1-CE2 4.23Å; I862-F909 HydrophobicContact CG1-CZ 4.25Å
863	E	93.6	Very high	90.4	Very high	9 Å²	9	21.2 Å²	21.2	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-45.3	175.1	-178.3	177.2	-169.5	0	0	112.1	S753 L756 G796 Y835 C859 T860 M861 A865 T866 G867 K868	S753-E863 VanDerWaalsContact CB-OE1 3.3Å; S753-E863 WeakPolarHBondContact CB-OE1 3.37Å; S753-E863 PolarHBondContact OG-OE1 3.03Å; L756-E863 HydrophobicContact CD1-CG 4.06Å; G796-E863 PolarHBondContact N-OE2 3.41Å; G796-E863 VanDerWaalsContact N-OE2 3.13Å; Y835-E863 VanDerWaalsContact OH-CD 3.25Å; Y835-E863 PolarHBondContact OH-OE2 3.11Å; C859-E863 PolarHBondContact O-N 3.23Å; T860-E863 WeakPolarHBondContact O-CB 3.44Å; T860-E863 PolarHBondContact O-N 3.2Å; M861-E863 VanDerWaalsContact C-N 3.29Å; E863-A865 PolarHBondContact O-N 2.65Å; E863-T866 PolarHBondContact O-N 3.09Å; E863-G867 VanDerWaalsContact O-CA 3.27Å; E863-G867 WeakPolarHBondContact O-CA 3.23Å; E863-G867 PolarHBondContact O-N 3.45Å; E863-K868 VanDerWaalsContact CA-O 3.29Å; E863-K868 WeakPolarHBondContact CA-O 3.44Å
864	M	93.6	Very high	89.9	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.3	-43.3	173.7	-75.1	-168.7	-72	0	0	112.6	L752 L756 L763 M770 A774 T860 M861	L752-M864 HydrophobicContact CD1-CG 4.32Å; L752-M864 HydrophobicContact CD1-SD 4.45Å; L752-M864 HydrophobicContact CD2-CG 3.82Å; L752-M864 HydrophobicContact CD2-SD 3.91Å; L752-M864 HydrophobicContact CG-CG 4.35Å; L756-M864 HydrophobicContact CD1-CG 4.13Å; L763-M864 WeakPolarHBondContact CB-O 3.33Å; L763-M864 HydrophobicContact CD1-CB 4.45Å; L763-M864 PolarHBondContact N-O 2.88Å; M770-M864 HydrophobicContact CG-CB 4.36Å; A774-M864 HydrophobicContact CB-CE 4.46Å; T860-M864 PolarHBondContact O-N 2.77Å; M861-M864 HydrophobicContact CE-CE 4.31Å; M861-M864 HydrophobicContact CG-CE 4.35Å; M861-M864 PolarHBondContact O-N 2.75Å; M861-M864 HydrophobicContact SD-CE 3.25Å; M861-M864 WeakPolarHBondContact SD-CE 3.36Å
865	A	91.5	Very high	88.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-44.7	179.8	0	0	0	0	0	111.8	P762 I764 M770 M861 I862 E863 P894 L897	P762-A865 VanDerWaalsContact CB-O 3.29Å; P762-A865 WeakPolarHBondContact CB-O 3.33Å; I764-A865 WeakPolarHBondContact CB-O 3.42Å; I764-A865 PolarHBondContact N-O 3.4Å; M770-A865 HydrophobicContact CE-CB 3.87Å; M770-A865 HydrophobicContact SD-CB 4.26Å; M861-A865 PolarHBondContact O-N 2.85Å; I862-A865 PolarHBondContact O-N 2.86Å; E863-A865 PolarHBondContact O-N 2.65Å; A865-P894 HydrophobicContact CB-CG 4.11Å; A865-L897 HydrophobicContact CB-CD1 4.06Å; A865-L897 HydrophobicContact CB-CD2 4.27Å
866	T	90.4	Very high	88	Confident	43 Å²	43	29.3 Å²	29.3	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-95	-15.2	-171.2	61.7	0	0	0	0	114.3	P762 I862 E863 K868 P894	P762-T866 WeakPolarHBondContact CG-O 3.48Å; I862-T866 HydrophobicContact CG2-CG2 4.31Å; I862-T866 WeakPolarHBondContact O-CB 3.33Å; I862-T866 WeakPolarHBondContact O-CG2 3.46Å; I862-T866 PolarHBondContact O-N 2.79Å; I862-T866 PolarHBondContact O-OG1 2.9Å; E863-T866 PolarHBondContact O-N 3.09Å; T866-K868 PolarHBondContact O-N 3.17Å; T866-K868 PolarHBondContact OG1-N 2.74Å; T866-K868 PolarHBondContact OG1-O 2.77Å; T866-K868 VanDerWaalsContact OG1-O 3.06Å; T866-P894 HydrophobicContact CG2-CG 3.55Å
867	G	87.7	Confident	87.1	Confident	14 Å²	14	31.3 Å²	31.3	14%	0.144	19%	0.191	C	C	.	.	S	Bend	trans	67	13.5	-170.4	0	0	0	0	0	113.9	E863	E863-G867 VanDerWaalsContact O-CA 3.27Å; E863-G867 WeakPolarHBondContact O-CA 3.23Å; E863-G867 PolarHBondContact O-N 3.45Å
868	K	88	Confident	86.3	Confident	126 Å²	126	37 Å²	37	55%	0.548	22%	0.218	S	C	.	.	S	Bend	trans	-138	153.9	-173.3	-64.4	-177.7	-175.9	179.3	0	110.4	E863 T866 V872	E863-K868 VanDerWaalsContact CA-O 3.29Å; E863-K868 WeakPolarHBondContact CA-O 3.44Å; T866-K868 PolarHBondContact O-N 3.17Å; T866-K868 PolarHBondContact OG1-N 2.74Å; T866-K868 PolarHBondContact OG1-O 2.77Å; T866-K868 VanDerWaalsContact OG1-O 3.06Å; K868-V872 HydrophobicContact CB-CG2 4.28Å
869	P	85.9	Confident	85.6	Confident	56 Å²	56	38.5 Å²	38.5	36%	0.364	23%	0.23	S	C	.	.			trans	-61.1	157.5	176.9	17.7	-24	0	0	0	112.2	V872	P869-V872 HydrophobicContact CB-CG2 4.17Å; P869-V872 HydrophobicContact CG-CG2 3.52Å; P869-V872 WeakPolarHBondContact O-CG2 3.31Å
870	P	85.8	Confident	84.8	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	150.4	177.6	28.9	-36.3	0	0	0	111.4	Q834 Y835 C859 V872 P891	Q834-P870 HydrophobicContact CB-CG 3.95Å; Q834-P870 PolarHBondContact OE1-O 2.97Å; Y835-P870 HydrophobicContact CD1-CG 4.38Å; Y835-P870 HydrophobicContact CD2-CG 4.09Å; Y835-P870 HydrophobicContact CE1-CG 4.12Å; Y835-P870 HydrophobicContact CE2-CG 3.79Å; Y835-P870 HydrophobicContact CG-CG 4.37Å; Y835-P870 WeakPolarHBondContact OH-CD 3.49Å; C859-P870 HydrophobicContact CB-CB 4.43Å; C859-P870 HydrophobicContact CB-CG 4.09Å; P870-V872 PolarHBondContact O-N 3.49Å; P870-P891 HydrophobicContact CB-CB 4.04Å; P870-P891 HydrophobicContact CB-CG 3.88Å
871	F	84.7	Confident	84	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.013	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	24.7	179.2	-61.5	-67.8	0	0	0	115.7	E873 L874 A880 K883 V884 P891	F871-E873 VanDerWaalsContact C-OE2 3.3Å; F871-E873 WeakPolarHBondContact CA-OE2 3.12Å; F871-E873 PolarHBondContact O-N 3.23Å; F871-E873 VanDerWaalsContact O-N 3.12Å; F871-L874 HydrophobicContact CB-CD1 3.91Å; F871-L874 HydrophobicContact CB-CG 4.21Å; F871-L874 HydrophobicContact CD1-CD1 3.73Å; F871-L874 HydrophobicContact CD1-CG 4.35Å; F871-L874 HydrophobicContact CE1-CD1 4.46Å; F871-L874 HydrophobicContact CG-CD1 4.04Å; F871-L874 WeakPolarHBondContact O-CB 3.44Å; F871-L874 PolarHBondContact O-N 3.4Å; F871-A880 HydrophobicContact CB-CB 3.91Å; F871-A880 HydrophobicContact CD2-CB 3.62Å; F871-A880 HydrophobicContact CE2-CB 4.24Å; F871-A880 HydrophobicContact CG-CB 3.89Å; F871-K883 HydrophobicContact CE1-CD 4.47Å; F871-V884 HydrophobicContact CE2-CG2 3.68Å; F871-V884 HydrophobicContact CZ-CG2 3.69Å; F871-P891 HydrophobicContact CD1-CB 4.44Å; F871-P891 HydrophobicContact CD2-CB 4.36Å; F871-P891 HydrophobicContact CD2-CG 4Å; F871-P891 VanDerWaalsContact CE1-CA 3.48Å; F871-P891 HydrophobicContact CE1-CB 4.23Å; F871-P891 HydrophobicContact CE1-CG 4.38Å; F871-P891 HydrophobicContact CE2-CB 4.15Å; F871-P891 HydrophobicContact CE2-CG 3.52Å; F871-P891 HydrophobicContact CZ-CB 4.09Å; F871-P891 HydrophobicContact CZ-CG 3.75Å; F871-P891 VanDerWaalsContact CZ-N 3.25Å
872	V	78	Confident	83.3	Confident	68 Å²	68	46.7 Å²	46.7	41%	0.412	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-55	-30.1	176.5	162.9	0	0	0	0	112.4	K868 P869 P870 L874 G875	K868-V872 HydrophobicContact CB-CG2 4.28Å; P869-V872 HydrophobicContact CB-CG2 4.17Å; P869-V872 HydrophobicContact CG-CG2 3.52Å; P869-V872 WeakPolarHBondContact O-CG2 3.31Å; P870-V872 PolarHBondContact O-N 3.49Å; V872-L874 PolarHBondContact O-N 3.29Å; V872-G875 PolarHBondContact O-N 2.87Å
873	E	78.4	Confident	82.7	Confident	111 Å²	111	49.9 Å²	49.9	52%	0.519	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-64	-20.6	176.4	69.7	-78.7	-179.9	0	0	114.5	F871 G875 P892	F871-E873 VanDerWaalsContact C-OE2 3.3Å; F871-E873 WeakPolarHBondContact CA-OE2 3.12Å; F871-E873 PolarHBondContact O-N 3.23Å; F871-E873 VanDerWaalsContact O-N 3.12Å; E873-G875 VanDerWaalsContact C-N 3.31Å; E873-P892 WeakPolarHBondContact OE1-CD 3.26Å; E873-P892 VanDerWaalsContact OE1-CG 3.28Å; E873-P892 WeakPolarHBondContact OE1-CG 3.2Å
874	L	79.2	Confident	82.1	Confident	51 Å²	51	49.6 Å²	49.6	27%	0.267	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-82.8	-8.6	179.4	-60.9	-177.4	0	0	0	113.2	F871 V872 S876 A879 A880 K883	F871-L874 HydrophobicContact CB-CD1 3.91Å; F871-L874 HydrophobicContact CB-CG 4.21Å; F871-L874 HydrophobicContact CD1-CD1 3.73Å; F871-L874 HydrophobicContact CD1-CG 4.35Å; F871-L874 HydrophobicContact CE1-CD1 4.46Å; F871-L874 HydrophobicContact CG-CD1 4.04Å; F871-L874 WeakPolarHBondContact O-CB 3.44Å; F871-L874 PolarHBondContact O-N 3.4Å; V872-L874 PolarHBondContact O-N 3.29Å; L874-S876 PolarHBondContact O-N 3.46Å; L874-A879 HydrophobicContact CB-CB 3.98Å; L874-A879 HydrophobicContact CD1-CB 4.33Å; L874-A880 HydrophobicContact CD1-CB 4.23Å; L874-K883 HydrophobicContact CD1-CB 4.49Å; L874-K883 HydrophobicContact CD1-CD 3.98Å; L874-K883 HydrophobicContact CD2-CD 4.36Å
875	G	72.4	Confident	81.3	Confident	75 Å²	75	50 Å²	50	77%	0.773	29%	0.285	S	S	*	.	S	Bend	trans	70.7	-36	177.8	0	0	0	0	0	115.8	V872 E873	V872-G875 PolarHBondContact O-N 2.87Å; E873-G875 VanDerWaalsContact C-N 3.31Å
876	S	77	Confident	80.7	Confident	45 Å²	45	56 Å²	56	32%	0.315	31%	0.314	S	S	.	.	S	Bend	trans	-120.2	138.1	178.3	71.5	0	0	0	0	112.8	L874 Q878 A879	L874-S876 PolarHBondContact O-N 3.46Å; S876-Q878 PolarHBondContact O-N 2.88Å; S876-A879 PolarHBondContact O-N 3.1Å; S876-A879 VanDerWaalsContact OG-CB 3.25Å; S876-A879 WeakPolarHBondContact OG-CB 3.26Å; S876-A879 PolarHBondContact OG-N 2.8Å
877	P	74.2	Confident	80.3	Confident	50 Å²	50	60.3 Å²	60.3	33%	0.325	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-29.9	173.5	-25.1	34.7	0	0	0	113.9	L833 Q834 A880 I881	L833-P877 HydrophobicContact CB-CB 3.96Å; L833-P877 HydrophobicContact CD1-CB 4.03Å; L833-P877 HydrophobicContact CG-CB 4.25Å; Q834-P877 HydrophobicContact CG-CB 4.12Å; P877-A880 WeakPolarHBondContact O-CB 3.46Å; P877-A880 PolarHBondContact O-N 3.33Å; P877-I881 PolarHBondContact O-N 2.81Å
878	Q	78.5	Confident	80.1	Confident	120 Å²	120	63.1 Å²	63.1	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-69.7	-33.9	178.3	-64.9	78.3	5.1	0	0	112.2	L833 S876 A880 I881 F882	L833-Q878 HydrophobicContact CD1-CG 4.2Å; S876-Q878 PolarHBondContact O-N 2.88Å; Q878-A880 VanDerWaalsContact C-N 3.25Å; Q878-A880 PolarHBondContact O-N 2.79Å; Q878-I881 PolarHBondContact O-N 2.91Å; Q878-F882 PolarHBondContact O-N 2.82Å
879	A	80.2	Confident	79.9	Confident	31 Å²	31	59.7 Å²	59.7	26%	0.256	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-33.3	174.2	0	0	0	0	0	112	L874 S876 F882 K883	L874-A879 HydrophobicContact CB-CB 3.98Å; L874-A879 HydrophobicContact CD1-CB 4.33Å; S876-A879 PolarHBondContact O-N 3.1Å; S876-A879 VanDerWaalsContact OG-CB 3.25Å; S876-A879 WeakPolarHBondContact OG-CB 3.26Å; S876-A879 PolarHBondContact OG-N 2.8Å; A879-F882 PolarHBondContact O-N 2.8Å; A879-K883 WeakPolarHBondContact O-CB 3.49Å; A879-K883 PolarHBondContact O-N 2.92Å
880	A	79	Confident	80	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-46	173.5	0	0	0	0	0	111.6	Q834 F871 L874 P877 Q878 F882 K883 V884	Q834-A880 HydrophobicContact CB-CB 4.39Å; Q834-A880 HydrophobicContact CG-CB 4Å; F871-A880 HydrophobicContact CB-CB 3.91Å; F871-A880 HydrophobicContact CD2-CB 3.62Å; F871-A880 HydrophobicContact CE2-CB 4.24Å; F871-A880 HydrophobicContact CG-CB 3.89Å; L874-A880 HydrophobicContact CD1-CB 4.23Å; P877-A880 WeakPolarHBondContact O-CB 3.46Å; P877-A880 PolarHBondContact O-N 3.33Å; Q878-A880 VanDerWaalsContact C-N 3.25Å; Q878-A880 PolarHBondContact O-N 2.79Å; A880-F882 PolarHBondContact O-N 2.86Å; A880-K883 PolarHBondContact O-N 2.95Å; A880-V884 WeakPolarHBondContact O-CB 3.25Å; A880-V884 VanDerWaalsContact O-CG2 3.24Å; A880-V884 WeakPolarHBondContact O-CG2 3.31Å; A880-V884 PolarHBondContact O-N 3.11Å
881	I	77.3	Confident	80	Confident	45 Å²	45	60.3 Å²	60.3	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-57.9	-49.3	175	-68.4	175.9	0	0	0	111	L833 I841 P877 Q878 K883 V884 G885	L833-I881 HydrophobicContact CB-CD1 3.64Å; L833-I881 HydrophobicContact CB-CG1 3.89Å; L833-I881 HydrophobicContact CD1-CD1 3.59Å; L833-I881 HydrophobicContact CD2-CD1 3.82Å; L833-I881 HydrophobicContact CG-CD1 3.83Å; I841-I881 HydrophobicContact CD1-CB 4.49Å; I841-I881 HydrophobicContact CD1-CG2 4.11Å; I841-I881 HydrophobicContact CG1-CG2 4.27Å; I841-I881 HydrophobicContact CG2-CG2 3.82Å; P877-I881 PolarHBondContact O-N 2.81Å; Q878-I881 PolarHBondContact O-N 2.91Å; I881-K883 VanDerWaalsContact C-N 3.25Å; I881-K883 PolarHBondContact O-N 2.99Å; I881-V884 PolarHBondContact O-N 2.88Å; I881-G885 WeakPolarHBondContact O-CA 3.41Å; I881-G885 PolarHBondContact O-N 2.93Å
882	F	79.5	Confident	80.1	Confident	127 Å²	127	63.5 Å²	63.5	56%	0.557	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-42.7	-179	-177.7	-98.3	0	0	0	110.9	Q878 A879 A880 M886 F887	Q878-F882 PolarHBondContact O-N 2.82Å; A879-F882 PolarHBondContact O-N 2.8Å; A880-F882 PolarHBondContact O-N 2.86Å; F882-M886 HydrophobicContact CD2-CG 3.94Å; F882-M886 HydrophobicContact CE1-CG 4.45Å; F882-M886 HydrophobicContact CE2-CG 3.71Å; F882-M886 HydrophobicContact CE2-SD 4.1Å; F882-M886 HydrophobicContact CG-CG 4.4Å; F882-M886 HydrophobicContact CZ-CG 3.99Å; F882-M886 HydrophobicContact CZ-SD 4.42Å; F882-M886 VanDerWaalsContact O-CB 3.24Å; F882-M886 WeakPolarHBondContact O-CB 3.47Å; F882-M886 WeakPolarHBondContact O-CG 3.44Å; F882-M886 PolarHBondContact O-N 3.01Å; F882-F887 HydrophobicContact CE1-CE2 4.06Å
883	K	81.6	Confident	80.7	Confident	72 Å²	72	61.9 Å²	61.9	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-68.6	-45.1	-179.3	-162.7	174.2	-176.5	179.6	0	112.7	F871 L874 A879 A880 I881 F887 V889	F871-K883 HydrophobicContact CE1-CD 4.47Å; L874-K883 HydrophobicContact CD1-CB 4.49Å; L874-K883 HydrophobicContact CD1-CD 3.98Å; L874-K883 HydrophobicContact CD2-CD 4.36Å; A879-K883 WeakPolarHBondContact O-CB 3.49Å; A879-K883 PolarHBondContact O-N 2.92Å; A880-K883 PolarHBondContact O-N 2.95Å; I881-K883 VanDerWaalsContact C-N 3.25Å; I881-K883 PolarHBondContact O-N 2.99Å; K883-F887 HydrophobicContact CG-CD2 4.45Å; K883-F887 WeakPolarHBondContact O-CB 3.47Å; K883-F887 PolarHBondContact O-N 2.9Å; K883-F887 VanDerWaalsContact O-N 3.07Å; K883-V889 HydrophobicContact CG-CB 4.24Å; K883-V889 HydrophobicContact CG-CG1 4.5Å
884	V	80.2	Confident	81.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-69.6	-44.8	178.5	178.3	0	0	0	0	110.8	P838 I841 W855 F871 A880 I881 K888 V889	P838-V884 HydrophobicContact CB-CG1 4.2Å; P838-V884 HydrophobicContact CG-CG1 3.73Å; I841-V884 HydrophobicContact CD1-CB 3.85Å; I841-V884 HydrophobicContact CD1-CG1 3.76Å; W855-V884 HydrophobicContact CH2-CG1 4.34Å; W855-V884 HydrophobicContact CZ2-CG1 3.77Å; W855-V884 HydrophobicContact CZ2-CG2 4.42Å; F871-V884 HydrophobicContact CE2-CG2 3.68Å; F871-V884 HydrophobicContact CZ-CG2 3.69Å; A880-V884 WeakPolarHBondContact O-CB 3.25Å; A880-V884 VanDerWaalsContact O-CG2 3.24Å; A880-V884 WeakPolarHBondContact O-CG2 3.31Å; A880-V884 PolarHBondContact O-N 3.11Å; I881-V884 PolarHBondContact O-N 2.88Å; V884-K888 WeakPolarHBondContact O-CA 3.45Å; V884-K888 PolarHBondContact O-N 2.98Å; V884-V889 WeakPolarHBondContact CG2-O 3.39Å
885	G	78.6	Confident	81.5	Confident	8 Å²	8	63.4 Å²	63.4	8%	0.082	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-52	-179.6	0	0	0	0	0	112.7	I881 K888	I881-G885 WeakPolarHBondContact O-CA 3.41Å; I881-G885 PolarHBondContact O-N 2.93Å; G885-K888 VanDerWaalsContact O-CE 3.27Å; G885-K888 WeakPolarHBondContact O-CE 3.25Å; G885-K888 PolarHBondContact O-NZ 3.28Å
886	M	78.8	Confident	82.2	Confident	125 Å²	125	68 Å²	68	62%	0.616	34%	0.341	S	S	*	.	H	α-helix	trans	-78.3	-41.8	-175.3	-65.1	-94.2	74.6	0	0	113.2	F882	F882-M886 HydrophobicContact CD2-CG 3.94Å; F882-M886 HydrophobicContact CE1-CG 4.45Å; F882-M886 HydrophobicContact CE2-CG 3.71Å; F882-M886 HydrophobicContact CE2-SD 4.1Å; F882-M886 HydrophobicContact CG-CG 4.4Å; F882-M886 HydrophobicContact CZ-CG 3.99Å; F882-M886 HydrophobicContact CZ-SD 4.42Å; F882-M886 VanDerWaalsContact O-CB 3.24Å; F882-M886 WeakPolarHBondContact O-CB 3.47Å; F882-M886 WeakPolarHBondContact O-CG 3.44Å; F882-M886 PolarHBondContact O-N 3.01Å
887	F	81.2	Confident	82.8	Confident	135 Å²	135	66.1 Å²	66.1	59%	0.592	33%	0.327	S	S	*	.	H	α-helix	trans	-108.4	-3.8	-171	-55.4	-75.4	0	0	0	113.9	F882 K883 V889	F882-F887 HydrophobicContact CE1-CE2 4.06Å; K883-F887 HydrophobicContact CG-CD2 4.45Å; K883-F887 WeakPolarHBondContact O-CB 3.47Å; K883-F887 PolarHBondContact O-N 2.9Å; K883-F887 VanDerWaalsContact O-N 3.07Å; F887-V889 HydrophobicContact CB-CB 4.43Å; F887-V889 HydrophobicContact CB-CG2 3.57Å; F887-V889 PolarHBondContact O-N 3.36Å; F887-V889 VanDerWaalsContact O-N 3.15Å
888	K	82.5	Confident	83.5	Confident	73 Å²	73	65.4 Å²	65.4	32%	0.317	32%	0.323	S	S	.	.			trans	55	30.2	-176.3	-48.1	-58.9	172.7	-160.2	0	112.8	P838 D842 V884 G885 A911	P838-K888 HydrophobicContact CB-CD 3.55Å; P838-K888 HydrophobicContact CG-CD 4.19Å; D842-K888 IonicContact OD1-NZ 3.02Å; D842-K888 PolarHBondContact OD1-NZ 3.39Å; D842-K888 IonicContact OD2-NZ 2.74Å; D842-K888 PolarHBondContact OD2-NZ 3.17Å; V884-K888 WeakPolarHBondContact O-CA 3.45Å; V884-K888 PolarHBondContact O-N 2.98Å; G885-K888 VanDerWaalsContact O-CE 3.27Å; G885-K888 WeakPolarHBondContact O-CE 3.25Å; G885-K888 PolarHBondContact O-NZ 3.28Å; K888-A911 HydrophobicContact CB-CB 4.11Å
889	V	84.6	Confident	83.9	Confident	54 Å²	54	64.6 Å²	64.6	33%	0.327	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-87.9	134.5	-176.6	174.1	0	0	0	0	110.4	K883 V884 F887	K883-V889 HydrophobicContact CG-CB 4.24Å; K883-V889 HydrophobicContact CG-CG1 4.5Å; V884-V889 WeakPolarHBondContact CG2-O 3.39Å; F887-V889 HydrophobicContact CB-CB 4.43Å; F887-V889 HydrophobicContact CB-CG2 3.57Å; F887-V889 PolarHBondContact O-N 3.36Å; F887-V889 VanDerWaalsContact O-N 3.15Å
890	H	87.7	Confident	84.3	Confident	69 Å²	69	63.9 Å²	63.9	32%	0.319	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-88.5	164.9	175.9	66	75.5	0	0	0	112.5	W855 F909	W855-H890 HydrophobicContact CH2-CB 4.06Å; W855-H890 HydrophobicContact CZ2-CB 4.38Å; H890-F909 HydrophobicContact CB-CB 3.61Å; H890-F909 HydrophobicContact CB-CD1 3.9Å; H890-F909 HydrophobicContact CB-CD2 3.67Å; H890-F909 HydrophobicContact CB-CE1 4.47Å; H890-F909 HydrophobicContact CB-CE2 4.26Å; H890-F909 HydrophobicContact CB-CG 3.47Å; H890-F909 VanDerWaalsContact CB-CG 3.47Å; H890-F909 AromaticContact CG-CD2 3.8Å; H890-F909 AromaticContact CG-CG 3.98Å; H890-F909 AromaticContact ND1-CD2 3.93Å
891	P	86.3	Confident	84.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-57.1	146.3	173.3	-18	26.6	0	0	0	112.2	I862 P870 F871 I893 F909	I862-P891 HydrophobicContact CG1-CB 4.42Å; I862-P891 HydrophobicContact CG2-CB 4.5Å; P870-P891 HydrophobicContact CB-CB 4.04Å; P870-P891 HydrophobicContact CB-CG 3.88Å; F871-P891 HydrophobicContact CD1-CB 4.44Å; F871-P891 HydrophobicContact CD2-CB 4.36Å; F871-P891 HydrophobicContact CD2-CG 4Å; F871-P891 VanDerWaalsContact CE1-CA 3.48Å; F871-P891 HydrophobicContact CE1-CB 4.23Å; F871-P891 HydrophobicContact CE1-CG 4.38Å; F871-P891 HydrophobicContact CE2-CB 4.15Å; F871-P891 HydrophobicContact CE2-CG 3.52Å; F871-P891 HydrophobicContact CZ-CB 4.09Å; F871-P891 HydrophobicContact CZ-CG 3.75Å; F871-P891 VanDerWaalsContact CZ-N 3.25Å; P891-I893 PolarHBondContact O-N 2.84Å; P891-F909 HydrophobicContact CG-CE1 4.36Å; P891-F909 HydrophobicContact CG-CZ 3.98Å
892	P	86.8	Confident	85.5	Confident	71 Å²	71	64.8 Å²	64.8	46%	0.461	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-61.8	127.7	179.2	25.7	-33.3	0	0	0	111.1	E873	E873-P892 WeakPolarHBondContact OE1-CD 3.26Å; E873-P892 VanDerWaalsContact OE1-CG 3.28Å; E873-P892 WeakPolarHBondContact OE1-CG 3.2Å
893	I	90.1	Very high	86.1	Confident	33 Å²	33	62 Å²	62	17%	0.169	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-83.9	124.5	177.2	-53.3	177	0	0	0	108.5	I862 P891 E895 L897 K902 I905 S906	I862-I893 HydrophobicContact CD1-CB 4.29Å; I862-I893 HydrophobicContact CD1-CG1 4.1Å; I862-I893 HydrophobicContact CD1-CG2 4.3Å; P891-I893 PolarHBondContact O-N 2.84Å; I893-E895 PolarHBondContact O-N 2.9Å; I893-L897 HydrophobicContact CG2-CD1 4.09Å; I893-K902 HydrophobicContact CG2-CB 4.42Å; I893-K902 HydrophobicContact CG2-CG 3.88Å; I893-I905 HydrophobicContact CD1-CB 4.4Å; I893-I905 HydrophobicContact CD1-CG2 3.98Å; I893-I905 HydrophobicContact CG1-CG2 4.11Å; I893-I905 HydrophobicContact CG2-CD1 4.48Å; I893-S906 VanDerWaalsContact CD1-OG 3.23Å; I893-S906 WeakPolarHBondContact CD1-OG 3.39Å
894	P	88.5	Confident	86.6	Confident	21 Å²	21	58.5 Å²	58.5	14%	0.136	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-56.8	130.8	-178.7	-27.3	34.3	0	0	0	113.6	I764 A865 T866 K896 L897 K902	I764-P894 HydrophobicContact CD1-CB 3.53Å; I764-P894 HydrophobicContact CD1-CG 4.36Å; A865-P894 HydrophobicContact CB-CG 4.11Å; T866-P894 HydrophobicContact CG2-CG 3.55Å; P894-K896 VanDerWaalsContact C-N 3.27Å; P894-K896 PolarHBondContact O-N 2.9Å; P894-L897 HydrophobicContact CB-CD1 4.15Å; P894-L897 HydrophobicContact CB-CG 4.22Å; P894-L897 HydrophobicContact CG-CD1 4.2Å; P894-L897 WeakPolarHBondContact O-CB 3.41Å; P894-L897 PolarHBondContact O-N 2.91Å; P894-K902 VanDerWaalsContact O-CE 3.25Å; P894-K902 WeakPolarHBondContact O-CE 3.43Å
895	E	86	Confident	87.3	Confident	174 Å²	174	58.4 Å²	58.4	81%	0.813	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-23	-176.6	-68.7	-173.4	174.4	0	0	114.1	I893 L897 K902	I893-E895 PolarHBondContact O-N 2.9Å; E895-L897 PolarHBondContact O-N 2.71Å; E895-K902 VanDerWaalsContact O-CE 3.31Å; E895-K902 WeakPolarHBondContact O-CE 3.44Å; E895-K902 PolarHBondContact O-NZ 3.15Å
896	K	87.7	Confident	88	Confident	171 Å²	171	60.6 Å²	60.6	74%	0.743	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.2	179.4	-58.9	-179	175.8	-176	0	113.7	I764 P894	I764-K896 HydrophobicContact CD1-CB 3.71Å; I764-K896 HydrophobicContact CD1-CD 4.3Å; I764-K896 HydrophobicContact CD1-CG 4.38Å; I764-K896 HydrophobicContact CG1-CB 4.03Å; P894-K896 VanDerWaalsContact C-N 3.27Å; P894-K896 PolarHBondContact O-N 2.9Å
897	L	88.5	Confident	88.7	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	31%	0.31	C	S	.	.	S	Bend	trans	-65.7	148.1	176.1	-69.3	171.9	0	0	0	111.2	I764 E767 M770 A865 I893 P894 E895 A901 K902 I905	I764-L897 HydrophobicContact CG1-CD2 3.93Å; I764-L897 HydrophobicContact CG1-CG 4.18Å; E767-L897 HydrophobicContact CG-CD2 4.35Å; E767-L897 WeakPolarHBondContact OE1-CA 3.48Å; M770-L897 HydrophobicContact CE-CD2 4.28Å; M770-L897 HydrophobicContact SD-CD2 4.21Å; A865-L897 HydrophobicContact CB-CD1 4.06Å; A865-L897 HydrophobicContact CB-CD2 4.27Å; I893-L897 HydrophobicContact CG2-CD1 4.09Å; P894-L897 HydrophobicContact CB-CD1 4.15Å; P894-L897 HydrophobicContact CB-CG 4.22Å; P894-L897 HydrophobicContact CG-CD1 4.2Å; P894-L897 WeakPolarHBondContact O-CB 3.41Å; P894-L897 PolarHBondContact O-N 2.91Å; E895-L897 PolarHBondContact O-N 2.71Å; L897-A901 HydrophobicContact CB-CB 4.18Å; L897-A901 HydrophobicContact CD2-CB 4.4Å; L897-K902 HydrophobicContact CB-CG 3.97Å; L897-K902 WeakPolarHBondContact O-CE 3.42Å; L897-K902 PolarHBondContact O-NZ 2.75Å; L897-I905 HydrophobicContact CD1-CD1 3.91Å
898	S	89.5	Confident	89.3	Confident	35 Å²	35	53.1 Å²	53.1	25%	0.245	28%	0.282	C	S	.	.			trans	-58.4	154.5	173.8	74.7	0	0	0	0	111	E767 C900 A901 K902	E767-S898 VanDerWaalsContact CD-OG 3.31Å; E767-S898 WeakPolarHBondContact OE1-CB 3.35Å; E767-S898 PolarHBondContact OE1-N 2.97Å; E767-S898 PolarHBondContact OE1-OG 2.9Å; E767-S898 WeakPolarHBondContact OE2-CB 3.42Å; E767-S898 PolarHBondContact OE2-OG 2.68Å; S898-C900 PolarHBondContact O-N 2.96Å; S898-A901 PolarHBondContact O-N 3.44Å; S898-A901 WeakPolarHBondContact OG-CB 3.31Å; S898-A901 PolarHBondContact OG-N 3.38Å; S898-A901 VanDerWaalsContact OG-N 3.07Å; S898-K902 WeakPolarHBondContact O-CG 3.5Å; S898-K902 PolarHBondContact O-N 3Å
899	S	86.8	Confident	89.8	Confident	103 Å²	103	50.2 Å²	50.2	72%	0.72	27%	0.269	S	S	*	.	H	α-helix	trans	-57.5	-32.5	174.5	52.2	0	0	0	0	111.9	S903	S899-S903 VanDerWaalsContact O-CB 3.31Å; S899-S903 WeakPolarHBondContact O-CB 3.46Å; S899-S903 PolarHBondContact O-N 3.27Å
900	C	88.8	Confident	90.2	Very high	16 Å²	16	48.9 Å²	48.9	11%	0.108	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-50.6	176.4	-171.7	0	0	0	0	111.8	S898 K902 S903 F904 F927 Q930	S898-C900 PolarHBondContact O-N 2.96Å; C900-K902 PolarHBondContact O-N 3.4Å; C900-S903 PolarHBondContact O-N 3.28Å; C900-F904 PolarHBondContact O-N 3.1Å; C900-F927 VanDerWaalsContact SG-CA 3.53Å; C900-Q930 PolarHBondContact SG-NE2 3.33Å; C900-Q930 VanDerWaalsContact SG-NE2 3.39Å
901	A	90	Very high	90	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-42.5	177	0	0	0	0	0	112.2	L897 S898 S903 F904 I905 F927	L897-A901 HydrophobicContact CB-CB 4.18Å; L897-A901 HydrophobicContact CD2-CB 4.4Å; S898-A901 PolarHBondContact O-N 3.44Å; S898-A901 WeakPolarHBondContact OG-CB 3.31Å; S898-A901 PolarHBondContact OG-N 3.38Å; S898-A901 VanDerWaalsContact OG-N 3.07Å; A901-S903 PolarHBondContact O-N 3.09Å; A901-F904 PolarHBondContact O-N 2.96Å; A901-I905 WeakPolarHBondContact O-CG1 3.45Å; A901-I905 PolarHBondContact O-N 3.35Å; A901-F927 HydrophobicContact CB-CD2 4.17Å; A901-F927 HydrophobicContact CB-CE2 3.68Å; A901-F927 HydrophobicContact CB-CZ 4.44Å
902	K	92	Very high	90	Very high	66 Å²	66	51 Å²	51	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.9	-71.8	175.4	179.4	162.5	0	112.3	I893 P894 E895 L897 S898 C900 S906	I893-K902 HydrophobicContact CG2-CB 4.42Å; I893-K902 HydrophobicContact CG2-CG 3.88Å; P894-K902 VanDerWaalsContact O-CE 3.25Å; P894-K902 WeakPolarHBondContact O-CE 3.43Å; E895-K902 VanDerWaalsContact O-CE 3.31Å; E895-K902 WeakPolarHBondContact O-CE 3.44Å; E895-K902 PolarHBondContact O-NZ 3.15Å; L897-K902 HydrophobicContact CB-CG 3.97Å; L897-K902 WeakPolarHBondContact O-CE 3.42Å; L897-K902 PolarHBondContact O-NZ 2.75Å; S898-K902 WeakPolarHBondContact O-CG 3.5Å; S898-K902 PolarHBondContact O-N 3Å; C900-K902 PolarHBondContact O-N 3.4Å; K902-S906 VanDerWaalsContact O-CB 3.31Å; K902-S906 WeakPolarHBondContact O-CB 3.42Å; K902-S906 PolarHBondContact O-N 2.85Å; K902-S906 PolarHBondContact O-OG 3.1Å
903	S	91.3	Very high	90	Very high	67 Å²	67	49.6 Å²	49.6	47%	0.469	27%	0.274	S	S	.	.	H	α-helix	trans	-61	-48.3	177.3	-176.2	0	0	0	0	111.1	S899 C900 A901 I905 S906 R907	S899-S903 VanDerWaalsContact O-CB 3.31Å; S899-S903 WeakPolarHBondContact O-CB 3.46Å; S899-S903 PolarHBondContact O-N 3.27Å; C900-S903 PolarHBondContact O-N 3.28Å; A901-S903 PolarHBondContact O-N 3.09Å; S903-I905 PolarHBondContact O-N 3.44Å; S903-S906 PolarHBondContact O-N 2.89Å; S903-R907 WeakPolarHBondContact O-CG 3.47Å; S903-R907 PolarHBondContact O-N 3.12Å; S903-R907 VanDerWaalsContact O-N 3.14Å
904	F	93.6	Very high	89.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-49.2	178.1	176.6	-101.4	0	0	0	112.7	L778 F857 M861 C900 A901 S906 R907 L922 D925 F927 F928	L778-F904 HydrophobicContact CD1-CE2 4.37Å; L778-F904 HydrophobicContact CD1-CZ 3.84Å; F857-F904 AromaticContact CE1-CE1 3.83Å; F857-F904 HydrophobicContact CE1-CE1 3.83Å; F857-F904 AromaticContact CE1-CZ 3.82Å; F857-F904 HydrophobicContact CE1-CZ 3.82Å; F857-F904 HydrophobicContact CZ-CE1 4.11Å; F857-F904 HydrophobicContact CZ-CZ 4.12Å; M861-F904 HydrophobicContact CE-CD1 4.14Å; M861-F904 HydrophobicContact CE-CE1 3.96Å; M861-F904 HydrophobicContact CG-CE1 4.37Å; M861-F904 HydrophobicContact SD-CE1 4.2Å; C900-F904 PolarHBondContact O-N 3.1Å; A901-F904 PolarHBondContact O-N 2.96Å; F904-S906 PolarHBondContact O-N 3.14Å; F904-R907 PolarHBondContact O-N 3.06Å; F904-L922 HydrophobicContact CD2-CD2 4.35Å; F904-L922 HydrophobicContact CE2-CB 4.26Å; F904-L922 HydrophobicContact CE2-CD2 3.99Å; F904-D925 HydrophobicContact CD2-CB 3.75Å; F904-D925 HydrophobicContact CE2-CB 3.98Å; F904-F927 HydrophobicContact CB-CB 3.91Å; F904-F927 HydrophobicContact CB-CD1 4.47Å; F904-F927 HydrophobicContact CB-CG 4.11Å; F904-F927 AromaticContact CD1-CD1 3.78Å; F904-F927 HydrophobicContact CD1-CD1 3.78Å; F904-F927 HydrophobicContact CD1-CE1 4.21Å; F904-F927 HydrophobicContact CD1-CG 4.27Å; F904-F927 HydrophobicContact CD2-CB 3.97Å; F904-F927 HydrophobicContact CD2-CD1 4.31Å; F904-F927 HydrophobicContact CD2-CG 4.44Å; F904-F927 HydrophobicContact CE1-CD1 4.01Å; F904-F927 HydrophobicContact CE1-CE1 4.34Å; F904-F927 HydrophobicContact CG-CB 3.93Å; F904-F927 AromaticContact CG-CD1 3.93Å; F904-F927 HydrophobicContact CG-CD1 3.93Å; F904-F927 HydrophobicContact CG-CG 4.03Å; F904-F927 HydrophobicContact CZ-CD1 4.35Å; F904-F928 AromaticContact CE2-CE2 3.83Å; F904-F928 HydrophobicContact CE2-CE2 3.83Å; F904-F928 HydrophobicContact CE2-CZ 4.02Å; F904-F928 HydrophobicContact CZ-CE2 4.04Å; F904-F928 AromaticContact CZ-CZ 3.76Å; F904-F928 HydrophobicContact CZ-CZ 3.76Å
905	I	93.7	Very high	89.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.8	-41.1	178.3	-65.2	171.3	0	0	0	110.9	M861 I862 I893 L897 A901 S903 R907 C908 F909	M861-I905 HydrophobicContact CB-CD1 4Å; M861-I905 HydrophobicContact CB-CG1 3.86Å; M861-I905 HydrophobicContact CE-CG1 4.35Å; M861-I905 HydrophobicContact CG-CG1 4.37Å; I862-I905 HydrophobicContact CD1-CD1 4.36Å; I862-I905 HydrophobicContact CD1-CG2 3.9Å; I862-I905 HydrophobicContact CG1-CG2 4.31Å; I893-I905 HydrophobicContact CD1-CB 4.4Å; I893-I905 HydrophobicContact CD1-CG2 3.98Å; I893-I905 HydrophobicContact CG1-CG2 4.11Å; I893-I905 HydrophobicContact CG2-CD1 4.48Å; L897-I905 HydrophobicContact CD1-CD1 3.91Å; A901-I905 WeakPolarHBondContact O-CG1 3.45Å; A901-I905 PolarHBondContact O-N 3.35Å; S903-I905 PolarHBondContact O-N 3.44Å; I905-R907 VanDerWaalsContact C-N 3.28Å; I905-R907 PolarHBondContact O-N 2.68Å; I905-C908 VanDerWaalsContact O-CB 3.31Å; I905-C908 WeakPolarHBondContact O-CB 3.27Å; I905-C908 PolarHBondContact O-N 2.66Å; I905-F909 HydrophobicContact CG2-CD2 4.01Å; I905-F909 HydrophobicContact CG2-CE2 3.52Å; I905-F909 HydrophobicContact CG2-CZ 4.44Å; I905-F909 WeakPolarHBondContact O-CD2 3.44Å
906	S	92.8	Very high	90.2	Very high	55 Å²	55	55.6 Å²	55.6	39%	0.385	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-35.3	179.9	-59.5	0	0	0	0	112.6	I893 K902 S903 F904 C908 F909	I893-S906 VanDerWaalsContact CD1-OG 3.23Å; I893-S906 WeakPolarHBondContact CD1-OG 3.39Å; K902-S906 VanDerWaalsContact O-CB 3.31Å; K902-S906 WeakPolarHBondContact O-CB 3.42Å; K902-S906 PolarHBondContact O-N 2.85Å; K902-S906 PolarHBondContact O-OG 3.1Å; S903-S906 PolarHBondContact O-N 2.89Å; F904-S906 PolarHBondContact O-N 3.14Å; S906-C908 VanDerWaalsContact C-N 3.26Å; S906-C908 PolarHBondContact O-N 2.82Å; S906-F909 PolarHBondContact O-N 3.23Å; S906-F909 VanDerWaalsContact O-N 3.11Å
907	R	93.3	Very high	90.5	Very high	103 Å²	103	48.3 Å²	48.3	39%	0.389	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-31.9	175.7	-69.1	179	70	169.9	5.5	112.7	S903 F904 I905 F909 P917 L922 D925	S903-R907 WeakPolarHBondContact O-CG 3.47Å; S903-R907 PolarHBondContact O-N 3.12Å; S903-R907 VanDerWaalsContact O-N 3.14Å; F904-R907 PolarHBondContact O-N 3.06Å; I905-R907 VanDerWaalsContact C-N 3.28Å; I905-R907 PolarHBondContact O-N 2.68Å; R907-F909 PolarHBondContact O-N 3.29Å; R907-P917 HydrophobicContact CB-CG 4.24Å; R907-P917 VanDerWaalsContact O-CD 3.23Å; R907-P917 WeakPolarHBondContact O-CD 3.34Å; R907-L922 HydrophobicContact CB-CD2 4.48Å; R907-D925 IonicContact CZ-OD2 3.83Å; R907-D925 IonicContact NH1-OD2 3.48Å; R907-D925 PolarHBondContact NH1-OD2 2.79Å
908	C	94.5	Very high	90.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-25	176.8	-58.8	0	0	0	0	112.2	V854 I905 S906 R916	V854-C908 HydrophobicContact CG1-CB 4.22Å; I905-C908 VanDerWaalsContact O-CB 3.31Å; I905-C908 WeakPolarHBondContact O-CB 3.27Å; I905-C908 PolarHBondContact O-N 2.66Å; S906-C908 VanDerWaalsContact C-N 3.26Å; S906-C908 PolarHBondContact O-N 2.82Å; C908-R916 VanDerWaalsContact O-CD 3.25Å; C908-R916 WeakPolarHBondContact O-CD 3.44Å; C908-R916 PolarHBondContact O-NE 3.33Å
909	F	94.2	Very high	90.9	Very high	12 Å²	12	49 Å²	49	5%	0.053	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	22.5	-175.6	-64.4	-48.1	0	0	0	114.6	W855 I862 H890 P891 I905 S906 R907 A911	W855-F909 AromaticContact CD2-CD1 3.75Å; W855-F909 HydrophobicContact CD2-CD1 3.75Å; W855-F909 HydrophobicContact CD2-CE1 4.29Å; W855-F909 AromaticContact CE2-CD1 3.9Å; W855-F909 HydrophobicContact CE3-CB 4.36Å; W855-F909 AromaticContact CE3-CD1 3.83Å; W855-F909 HydrophobicContact CE3-CD1 3.83Å; W855-F909 HydrophobicContact CG-CD1 4.29Å; W855-F909 HydrophobicContact CG-CE1 4.5Å; W855-F909 HydrophobicContact CH2-CB 4.49Å; W855-F909 HydrophobicContact CH2-CD1 4.2Å; W855-F909 HydrophobicContact CZ2-CD1 4.14Å; W855-F909 HydrophobicContact CZ3-CB 4.05Å; W855-F909 HydrophobicContact CZ3-CD1 4.05Å; W855-F909 WeakPolarHBondContact CZ3-O 3.24Å; I862-F909 HydrophobicContact CG1-CE2 4.23Å; I862-F909 HydrophobicContact CG1-CZ 4.25Å; H890-F909 HydrophobicContact CB-CB 3.61Å; H890-F909 HydrophobicContact CB-CD1 3.9Å; H890-F909 HydrophobicContact CB-CD2 3.67Å; H890-F909 HydrophobicContact CB-CE1 4.47Å; H890-F909 HydrophobicContact CB-CE2 4.26Å; H890-F909 HydrophobicContact CB-CG 3.47Å; H890-F909 VanDerWaalsContact CB-CG 3.47Å; H890-F909 AromaticContact CG-CD2 3.8Å; H890-F909 AromaticContact CG-CG 3.98Å; H890-F909 AromaticContact ND1-CD2 3.93Å; P891-F909 HydrophobicContact CG-CE1 4.36Å; P891-F909 HydrophobicContact CG-CZ 3.98Å; I905-F909 HydrophobicContact CG2-CD2 4.01Å; I905-F909 HydrophobicContact CG2-CE2 3.52Å; I905-F909 HydrophobicContact CG2-CZ 4.44Å; I905-F909 WeakPolarHBondContact O-CD2 3.44Å; S906-F909 PolarHBondContact O-N 3.23Å; S906-F909 VanDerWaalsContact O-N 3.11Å; R907-F909 PolarHBondContact O-N 3.29Å; F909-A911 PolarHBondContact O-N 3.17Å; F909-A911 VanDerWaalsContact O-N 3.13Å
910	A	91.1	Very high	91.2	Very high	25 Å²	25	46.7 Å²	46.7	21%	0.207	26%	0.259	C	S	.	.			trans	-58.7	119.2	169.7	0	0	0	0	0	110.1	N912 R916	A910-N912 VanDerWaalsContact C-N 3.34Å; A910-N912 PolarHBondContact O-N 3.38Å; A910-R916 HydrophobicContact CB-CB 4.03Å; A910-R916 HydrophobicContact CB-CG 4.27Å; A910-R916 PolarHBondContact O-NE 2.81Å; A910-R916 PolarHBondContact O-NH2 3.02Å
911	A	85.5	Confident	91.4	Very high	46 Å²	46	49.2 Å²	49.2	38%	0.38	27%	0.273	S	S	.	.	S	Bend	trans	-63.8	-37.4	-175.4	0	0	0	0	0	112.6	K888 F909 P913	K888-A911 HydrophobicContact CB-CB 4.11Å; F909-A911 PolarHBondContact O-N 3.17Å; F909-A911 VanDerWaalsContact O-N 3.13Å; A911-P913 WeakPolarHBondContact O-CD 3.23Å
912	N	84.8	Confident	91.6	Very high	67 Å²	67	49.2 Å²	49.2	36%	0.358	27%	0.273	S	S	.	.	S	Bend	trans	-79.3	117.3	173	-178	-10.2	0	0	0	109.9	A910 K914 Q915 R916	A910-N912 VanDerWaalsContact C-N 3.34Å; A910-N912 PolarHBondContact O-N 3.38Å; N912-K914 PolarHBondContact O-N 3.45Å; N912-K914 VanDerWaalsContact O-N 3.13Å; N912-K914 WeakPolarHBondContact OD1-CB 3.4Å; N912-K914 PolarHBondContact OD1-N 3.31Å; N912-Q915 HydrophobicContact CB-CB 4.23Å; N912-Q915 HydrophobicContact CB-CG 4.12Å; N912-Q915 PolarHBondContact O-N 2.97Å; N912-R916 PolarHBondContact O-N 3.24Å
913	P	86.6	Confident	91.6	Very high	42 Å²	42	48 Å²	48	27%	0.273	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.4	-178.6	23.9	-34	0	0	0	113.4	E839 P851 A911 Q915 R916	E839-P913 HydrophobicContact CB-CG 4.41Å; E839-P913 HydrophobicContact CG-CB 4.42Å; E839-P913 HydrophobicContact CG-CG 4.36Å; P851-P913 HydrophobicContact CB-CB 3.93Å; P851-P913 HydrophobicContact CG-CB 4.36Å; A911-P913 WeakPolarHBondContact O-CD 3.23Å; P913-Q915 VanDerWaalsContact C-N 3.34Å; P913-R916 PolarHBondContact O-N 3.4Å
914	K	86.1	Confident	91.6	Very high	196 Å²	196	51.7 Å²	51.7	85%	0.852	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-22.8	176.2	-64.3	-175.7	178.4	-179.2	0	113.7	N912	N912-K914 PolarHBondContact O-N 3.45Å; N912-K914 VanDerWaalsContact O-N 3.13Å; N912-K914 WeakPolarHBondContact OD1-CB 3.4Å; N912-K914 PolarHBondContact OD1-N 3.31Å
915	Q	89.9	Confident	91.4	Very high	146 Å²	146	52.4 Å²	52.4	68%	0.682	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-14.5	177.5	-67.6	176.3	-14.6	0	0	112	N912 P913	N912-Q915 HydrophobicContact CB-CB 4.23Å; N912-Q915 HydrophobicContact CB-CG 4.12Å; N912-Q915 PolarHBondContact O-N 2.97Å; P913-Q915 VanDerWaalsContact C-N 3.34Å
916	R	93.9	Very high	91	Very high	13 Å²	13	59.5 Å²	59.5	5%	0.049	32%	0.316	C	S	.	.	S	Bend	trans	-71.9	129.6	178.1	-159.5	179	-62.1	148	6.8	109.4	E839 P851 V854 C908 A910 N912 P913	E839-R916 IonicContact OE1-CZ 3.51Å; E839-R916 IonicContact OE1-NH1 3.28Å; E839-R916 PolarHBondContact OE1-NH1 2.79Å; E839-R916 IonicContact OE1-NH2 3.85Å; E839-R916 PolarHBondContact OE1-NH2 3.07Å; E839-R916 IonicContact OE2-CZ 3.69Å; E839-R916 IonicContact OE2-NH1 2.64Å; E839-R916 IonicContact OE2-NH2 2.73Å; E839-R916 PolarHBondContact OE2-NH2 2.58Å; P851-R916 VanDerWaalsContact C-NH1 3.26Å; P851-R916 HydrophobicContact CB-CB 4.46Å; P851-R916 WeakPolarHBondContact O-CD 3.44Å; P851-R916 PolarHBondContact O-NH1 2.69Å; V854-R916 HydrophobicContact CB-CG 4.36Å; V854-R916 HydrophobicContact CG1-CG 4Å; C908-R916 VanDerWaalsContact O-CD 3.25Å; C908-R916 WeakPolarHBondContact O-CD 3.44Å; C908-R916 PolarHBondContact O-NE 3.33Å; A910-R916 HydrophobicContact CB-CB 4.03Å; A910-R916 HydrophobicContact CB-CG 4.27Å; A910-R916 PolarHBondContact O-NE 2.81Å; A910-R916 PolarHBondContact O-NH2 3.02Å; N912-R916 PolarHBondContact O-N 3.24Å; P913-R916 PolarHBondContact O-N 3.4Å
917	P	93.8	Very high	90.8	Very high	17 Å²	17	57.1 Å²	57.1	11%	0.11	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-65.8	149.5	179.4	28.9	-35.2	0	0	0	110.9	R907 V921 L922	R907-P917 HydrophobicContact CB-CG 4.24Å; R907-P917 VanDerWaalsContact O-CD 3.23Å; R907-P917 WeakPolarHBondContact O-CD 3.34Å; P917-V921 HydrophobicContact CB-CB 4.18Å; P917-V921 HydrophobicContact CB-CG1 3.93Å; P917-L922 HydrophobicContact CB-CD2 4.19Å; P917-L922 HydrophobicContact CB-CG 4.08Å; P917-L922 HydrophobicContact CG-CD1 4.25Å; P917-L922 HydrophobicContact CG-CD2 3.56Å; P917-L922 HydrophobicContact CG-CG 3.78Å
918	S	93	Very high	90.5	Very high	56 Å²	56	52.9 Å²	52.9	39%	0.392	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-73.8	162	170.7	67.8	0	0	0	0	111.1	A920 V921 L922	S918-A920 PolarHBondContact O-N 3.41Å; S918-V921 PolarHBondContact O-N 2.93Å; S918-V921 WeakPolarHBondContact OG-CG2 3.11Å; S918-V921 PolarHBondContact OG-N 2.92Å; S918-L922 PolarHBondContact O-N 2.76Å
919	A	93.5	Very high	89.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.7	-40.1	175.9	0	0	0	0	0	112.2	L778 L781 A782 V921 L922 L923	L778-A919 HydrophobicContact CD2-CB 3.98Å; L781-A919 HydrophobicContact CB-CB 3.85Å; A782-A919 HydrophobicContact CB-CB 4.13Å; A919-V921 VanDerWaalsContact C-N 3.32Å; A919-V921 PolarHBondContact O-N 2.52Å; A919-L922 PolarHBondContact O-N 3Å; A919-L923 WeakPolarHBondContact O-CG 3.45Å; A919-L923 PolarHBondContact O-N 3.3Å; A919-L923 VanDerWaalsContact O-N 3.1Å
920	A	92.4	Very high	88.2	Confident	53 Å²	53	61 Å²	61	44%	0.438	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-33.6	176.2	0	0	0	0	0	113.5	A782 S918 N924	A782-A920 HydrophobicContact CB-CB 4.42Å; S918-A920 PolarHBondContact O-N 3.41Å; A920-N924 PolarHBondContact O-ND2 3.13Å
921	V	93.5	Very high	86.2	Confident	69 Å²	69	62.6 Å²	62.6	42%	0.418	33%	0.332	S	S	.	.	H	α-helix	trans	-74.2	-39.9	175.2	171.6	0	0	0	0	110.8	P917 S918 A919 L923 N924	P917-V921 HydrophobicContact CB-CB 4.18Å; P917-V921 HydrophobicContact CB-CG1 3.93Å; S918-V921 PolarHBondContact O-N 2.93Å; S918-V921 WeakPolarHBondContact OG-CG2 3.11Å; S918-V921 PolarHBondContact OG-N 2.92Å; A919-V921 VanDerWaalsContact C-N 3.32Å; A919-V921 PolarHBondContact O-N 2.52Å; V921-L923 VanDerWaalsContact C-N 3.29Å; V921-L923 PolarHBondContact O-N 3.47Å; V921-N924 PolarHBondContact O-N 3.15Å
922	L	93.7	Very high	84.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-32.9	178	-75.1	173.7	0	0	0	112.8	L778 V854 F904 R907 P917 S918 A919 N924 D925 F928	L778-L922 HydrophobicContact CD1-CB 3.7Å; L778-L922 HydrophobicContact CD2-CB 4.16Å; L778-L922 HydrophobicContact CD2-CD1 4.03Å; V854-L922 HydrophobicContact CG1-CD1 3.53Å; F904-L922 HydrophobicContact CD2-CD2 4.35Å; F904-L922 HydrophobicContact CE2-CB 4.26Å; F904-L922 HydrophobicContact CE2-CD2 3.99Å; R907-L922 HydrophobicContact CB-CD2 4.48Å; P917-L922 HydrophobicContact CB-CD2 4.19Å; P917-L922 HydrophobicContact CB-CG 4.08Å; P917-L922 HydrophobicContact CG-CD1 4.25Å; P917-L922 HydrophobicContact CG-CD2 3.56Å; P917-L922 HydrophobicContact CG-CG 3.78Å; S918-L922 PolarHBondContact O-N 2.76Å; A919-L922 PolarHBondContact O-N 3Å; L922-N924 PolarHBondContact O-N 3.4Å; L922-N924 VanDerWaalsContact O-N 3.12Å; L922-D925 VanDerWaalsContact O-CB 3.23Å; L922-D925 WeakPolarHBondContact O-CB 3.45Å; L922-D925 PolarHBondContact O-N 3.5Å; L922-F928 WeakPolarHBondContact O-CE2 3.34Å
923	L	92.8	Very high	82	Confident	41 Å²	41	69.9 Å²	69.9	22%	0.215	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.6	176.5	-77.1	170.9	0	0	0	114.2	K775 L778 E779 A782 A919 V921	K775-L923 HydrophobicContact CG-CD2 4.07Å; L778-L923 HydrophobicContact CB-CD2 3.5Å; L778-L923 VanDerWaalsContact CB-CD2 3.5Å; L778-L923 HydrophobicContact CB-CG 3.86Å; L778-L923 HydrophobicContact CD1-CD2 4.36Å; E779-L923 HydrophobicContact CG-CD1 4.15Å; E779-L923 HydrophobicContact CG-CD2 3.85Å; A782-L923 HydrophobicContact CB-CD1 3.93Å; A919-L923 WeakPolarHBondContact O-CG 3.45Å; A919-L923 PolarHBondContact O-N 3.3Å; A919-L923 VanDerWaalsContact O-N 3.1Å; V921-L923 VanDerWaalsContact C-N 3.29Å; V921-L923 PolarHBondContact O-N 3.47Å
924	N	90.1	Very high	79.4	Confident	144 Å²	144	76.7 Å²	76.7	77%	0.77	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	15.4	178.5	-61.4	-55.7	0	0	0	113	A920 V921 L922	A920-N924 PolarHBondContact O-ND2 3.13Å; V921-N924 PolarHBondContact O-N 3.15Å; L922-N924 PolarHBondContact O-N 3.4Å; L922-N924 VanDerWaalsContact O-N 3.12Å
925	D	90.6	Very high	76.7	Confident	16 Å²	16	79.2 Å²	79.2	9%	0.086	39%	0.393	C	S	.	.	S	Bend	trans	-77.9	146.3	179.7	-165.2	-81.9	0	0	0	112.4	F904 R907 L922 F927 F928	F904-D925 HydrophobicContact CD2-CB 3.75Å; F904-D925 HydrophobicContact CE2-CB 3.98Å; R907-D925 IonicContact CZ-OD2 3.83Å; R907-D925 IonicContact NH1-OD2 3.48Å; R907-D925 PolarHBondContact NH1-OD2 2.79Å; L922-D925 VanDerWaalsContact O-CB 3.23Å; L922-D925 WeakPolarHBondContact O-CB 3.45Å; L922-D925 PolarHBondContact O-N 3.5Å; D925-F927 PolarHBondContact O-N 3.38Å; D925-F927 PolarHBondContact OD1-N 2.99Å; D925-F928 PolarHBondContact O-N 2.99Å
926	Y	85.8	Confident	73.7	Confident	149 Å²	149	81.5 Å²	81.5	58%	0.584	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-57.6	-21.2	180	-172.1	-103.7	0	0	0	113.7	F928 D929 Q930	Y926-F928 PolarHBondContact O-N 3.46Å; Y926-F928 VanDerWaalsContact O-N 3.15Å; Y926-D929 HydrophobicContact CD2-CB 4.05Å; Y926-D929 VanDerWaalsContact CD2-OD2 3.23Å; Y926-D929 WeakPolarHBondContact CD2-OD2 3.41Å; Y926-D929 HydrophobicContact CE2-CB 4.16Å; Y926-D929 WeakPolarHBondContact O-CB 3.37Å; Y926-D929 PolarHBondContact O-N 3.44Å; Y926-Q930 HydrophobicContact CE1-CG 4.29Å
927	F	87.9	Confident	70.7	Confident	4 Å²	4	85.7 Å²	85.7	2%	0.018	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-53.5	-31.6	173.1	-177.7	-118.5	0	0	0	113.2	A771 M861 C900 A901 F904 D925	A771-F927 HydrophobicContact CB-CD1 4.27Å; A771-F927 HydrophobicContact CB-CE1 3.68Å; A771-F927 HydrophobicContact CB-CZ 3.86Å; M861-F927 HydrophobicContact CE-CE1 3.95Å; M861-F927 HydrophobicContact CE-CZ 4.27Å; C900-F927 VanDerWaalsContact SG-CA 3.53Å; A901-F927 HydrophobicContact CB-CD2 4.17Å; A901-F927 HydrophobicContact CB-CE2 3.68Å; A901-F927 HydrophobicContact CB-CZ 4.44Å; F904-F927 HydrophobicContact CB-CB 3.91Å; F904-F927 HydrophobicContact CB-CD1 4.47Å; F904-F927 HydrophobicContact CB-CG 4.11Å; F904-F927 AromaticContact CD1-CD1 3.78Å; F904-F927 HydrophobicContact CD1-CD1 3.78Å; F904-F927 HydrophobicContact CD1-CE1 4.21Å; F904-F927 HydrophobicContact CD1-CG 4.27Å; F904-F927 HydrophobicContact CD2-CB 3.97Å; F904-F927 HydrophobicContact CD2-CD1 4.31Å; F904-F927 HydrophobicContact CD2-CG 4.44Å; F904-F927 HydrophobicContact CE1-CD1 4.01Å; F904-F927 HydrophobicContact CE1-CE1 4.34Å; F904-F927 HydrophobicContact CG-CB 3.93Å; F904-F927 AromaticContact CG-CD1 3.93Å; F904-F927 HydrophobicContact CG-CD1 3.93Å; F904-F927 HydrophobicContact CG-CG 4.03Å; F904-F927 HydrophobicContact CZ-CD1 4.35Å; D925-F927 PolarHBondContact O-N 3.38Å; D925-F927 PolarHBondContact OD1-N 2.99Å
928	F	87.5	Confident	67.6	Low	15 Å²	15	94.2 Å²	94.2	7%	0.066	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-82.3	-20.2	178.7	-60.2	-60.9	0	0	0	113.9	A771 A774 K775 L778 F904 L922 D925 Y926 Q930 T931	A771-F928 HydrophobicContact CB-CD1 4.22Å; A771-F928 HydrophobicContact CB-CE1 4.43Å; A771-F928 WeakPolarHBondContact O-CE1 3.29Å; A774-F928 HydrophobicContact CB-CE1 4.05Å; A774-F928 HydrophobicContact CB-CZ 4.28Å; K775-F928 HydrophobicContact CB-CD1 3.95Å; K775-F928 HydrophobicContact CB-CE1 3.68Å; K775-F928 HydrophobicContact CB-CZ 4.29Å; L778-F928 HydrophobicContact CD1-CE2 4.07Å; L778-F928 HydrophobicContact CD1-CZ 3.87Å; F904-F928 AromaticContact CE2-CE2 3.83Å; F904-F928 HydrophobicContact CE2-CE2 3.83Å; F904-F928 HydrophobicContact CE2-CZ 4.02Å; F904-F928 HydrophobicContact CZ-CE2 4.04Å; F904-F928 AromaticContact CZ-CZ 3.76Å; F904-F928 HydrophobicContact CZ-CZ 3.76Å; L922-F928 WeakPolarHBondContact O-CE2 3.34Å; D925-F928 PolarHBondContact O-N 2.99Å; Y926-F928 PolarHBondContact O-N 3.46Å; Y926-F928 VanDerWaalsContact O-N 3.15Å; F928-Q930 VanDerWaalsContact C-N 3.31Å; F928-Q930 PolarHBondContact O-N 2.93Å; F928-T931 PolarHBondContact O-N 3.05Å; F928-T931 PolarHBondContact O-OG1 3.26Å
929	D	78.9	Confident	64.6	Low	98 Å²	98	97.6 Å²	97.6	52%	0.524	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-70.4	-26.9	-177.8	-68.4	-24.9	0	0	0	112.8	Y926 T931	Y926-D929 HydrophobicContact CD2-CB 4.05Å; Y926-D929 VanDerWaalsContact CD2-OD2 3.23Å; Y926-D929 WeakPolarHBondContact CD2-OD2 3.41Å; Y926-D929 HydrophobicContact CE2-CB 4.16Å; Y926-D929 WeakPolarHBondContact O-CB 3.37Å; Y926-D929 PolarHBondContact O-N 3.44Å; D929-T931 PolarHBondContact O-N 3.14Å
930	Q	60.4	Low	61.3	Low	84 Å²	84	104.2 Å²	104.2	39%	0.393	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-70.1	-13.3	-179.6	-59.2	-169.1	11.2	0	0	113.4	C900 Y926 F928	C900-Q930 PolarHBondContact SG-NE2 3.33Å; C900-Q930 VanDerWaalsContact SG-NE2 3.39Å; Y926-Q930 HydrophobicContact CE1-CG 4.29Å; F928-Q930 VanDerWaalsContact C-N 3.31Å; F928-Q930 PolarHBondContact O-N 2.93Å
931	T	49.6	Very low	58.3	Low	59 Å²	59	107.8 Å²	107.8	36%	0.362	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-80.5	-13.8	-177.4	64.9	0	0	0	0	114	A771 F928 D929 V933	A771-T931 HydrophobicContact CB-CG2 3.54Å; F928-T931 PolarHBondContact O-N 3.05Å; F928-T931 PolarHBondContact O-OG1 3.26Å; D929-T931 PolarHBondContact O-N 3.14Å; T931-V933 PolarHBondContact O-N 3.13Å
932	H	41.5	Very low	55	Low	153 Å²	153	111.9 Å²	111.9	71%	0.708	55%	0.55	S	S	*	*			trans	-79.9	69.6	169.4	-72.9	-80.9	0	0	0	110.5	K934	H932-K934 VanDerWaalsContact C-N 3.34Å; H932-K934 PolarHBondContact O-N 2.84Å
933	V	40.6	Very low	52.1	Low	113 Å²	113	120.9 Å²	120.9	69%	0.685	59%	0.59	S	S	*	*			trans	-62.9	101.5	168.3	178.5	0	0	0	0	108.1	T931 R935	T931-V933 PolarHBondContact O-N 3.13Å; V933-R935 PolarHBondContact O-N 3.46Å; V933-R935 VanDerWaalsContact O-N 3.14Å
934	K	31.5	Very low	48.9	Very low	184 Å²	184	130.1 Å²	130.1	80%	0.8	62%	0.622	S	S	*	*			trans	-39.1	115.7	166.3	-66	173.8	178.5	176.2	0	108.9	H932 K936	H932-K934 VanDerWaalsContact C-N 3.34Å; H932-K934 PolarHBondContact O-N 2.84Å; K934-K936 VanDerWaalsContact C-N 3.29Å; K934-K936 PolarHBondContact O-N 3.12Å
935	R	29	Very low	45.9	Very low	250 Å²	250	132.1 Å²	132.1	94%	0.943	63%	0.626	S	S	*	*			trans	-54.3	92.2	169	-79.5	176.7	166.1	148.1	-5	108.5	V933 S937	V933-R935 PolarHBondContact O-N 3.46Å; V933-R935 VanDerWaalsContact O-N 3.14Å; R935-S937 PolarHBondContact O-N 3.47Å
936	K	28.6	Very low	42.7	Very low	193 Å²	193	138.2 Å²	138.2	84%	0.839	66%	0.659	S	S	*	*			trans	-77	112.1	166.6	-87.8	-175.2	173.3	179.5	0	107.4	K934	K934-K936 VanDerWaalsContact C-N 3.29Å; K934-K936 PolarHBondContact O-N 3.12Å
937	S	30.8	Very low	39.8	Very low	102 Å²	102	142 Å²	142	71%	0.713	67%	0.674	S	S	*	*			trans	23.2	111.3	155.5	54.5	0	0	0	0	116.8	R935 V939	R935-S937 PolarHBondContact O-N 3.47Å; S937-V939 PolarHBondContact O-N 3.19Å
938	K	28.1	Very low	36.9	Very low	195 Å²	195	153.5 Å²	153.5	85%	0.848	72%	0.717	S	S	*	*			trans	-33.6	119.2	160.5	-73.8	174.5	171.4	-179	0	110.8
939	V	29.2	Very low	34	Very low	127 Å²	127	157.9 Å²	157.9	77%	0.77	75%	0.747	S	S	*	*			trans	-77	118.5	152.3	175.5	0	0	0	0	105	S937 I941	S937-V939 PolarHBondContact O-N 3.19Å; V939-I941 HydrophobicContact CG1-CG1 4.42Å; V939-I941 PolarHBondContact O-N 2.98Å
940	D	26	Very low	31.5	Very low	139 Å²	139	159.2 Å²	159.2	74%	0.743	76%	0.761	S	S	*	*			trans	-60.5	98.1	176.7	-72.7	-42.6	0	0	0	109.7
941	I	29	Very low	30	Very low	129 Å²	129	161.3 Å²	161.3	66%	0.662	78%	0.779	S	S	*	*			trans	-103.8	98.5	163.6	-57.1	-179.1	0	0	0	106	V939 F943	V939-I941 HydrophobicContact CG1-CG1 4.42Å; V939-I941 PolarHBondContact O-N 2.98Å; I941-F943 VanDerWaalsContact C-N 3.28Å; I941-F943 HydrophobicContact CG2-CD2 4.02Å; I941-F943 HydrophobicContact CG2-CE2 4.24Å; I941-F943 PolarHBondContact O-N 2.81Å
942	N	23.6	Very low	28.7	Very low	154 Å²	154	170.2 Å²	170.2	82%	0.824	81%	0.806	S	S	*	*			trans	-60.3	85.7	171.1	-78.7	-36.3	0	0	0	109.9	R944	N942-R944 PolarHBondContact O-N 3.06Å
943	F	32.2	Very low	28	Very low	190 Å²	190	168.2 Å²	168.2	83%	0.833	81%	0.81	S	S	*	*			trans	-73.3	105	161.6	-104.3	-91	0	0	0	107.8	I941 E945	I941-F943 VanDerWaalsContact C-N 3.28Å; I941-F943 HydrophobicContact CG2-CD2 4.02Å; I941-F943 HydrophobicContact CG2-CE2 4.24Å; I941-F943 PolarHBondContact O-N 2.81Å; F943-E945 PolarHBondContact O-N 3.44Å; F943-E945 VanDerWaalsContact O-N 3.08Å
944	R	26.2	Very low	27.3	Very low	235 Å²	235	167.6 Å²	167.6	89%	0.887	82%	0.816	S	S	*	*			trans	-41.6	112.5	170	-91.5	173.9	153.3	171.9	-6.4	110.4	N942 N946	N942-R944 PolarHBondContact O-N 3.06Å; R944-N946 PolarHBondContact O-N 3.47Å; R944-N946 VanDerWaalsContact O-N 3.08Å
945	E	26.3	Very low	26.9	Very low	185 Å²	185	164.2 Å²	164.2	86%	0.864	82%	0.816	S	S	*	*			trans	-58.1	103.9	156.6	-75.7	177.6	138.7	0	0	108.3	F943	F943-E945 PolarHBondContact O-N 3.44Å; F943-E945 VanDerWaalsContact O-N 3.08Å
946	N	25.3	Very low	26.5	Very low	144 Å²	144	163 Å²	163	77%	0.77	81%	0.813	S	S	*	*			trans	-164.5	139.8	149.2	-89	-26.3	0	0	0	106	R944	R944-N946 PolarHBondContact O-N 3.47Å; R944-N946 VanDerWaalsContact O-N 3.08Å
947	Y	25	Very low	26.4	Very low	230 Å²	230	161.6 Å²	161.6	90%	0.902	81%	0.813	S	S	*	*			trans	90.9	67.4	-170.8	-59.8	-83.9	0	0	0	115.9
948	R	26.2	Very low	25.9	Very low	244 Å²	244	162.1 Å²	162.1	92%	0.921	82%	0.816	S	S	*	*			trans	-76.1	122.2	145.4	-83.6	-175.9	175.6	-177.3	-1.2	108.6
949	P	26.4	Very low	25.7	Very low	108 Å²	108	157.2 Å²	157.2	70%	0.701	81%	0.812	S	S	*	*			trans	-70.9	149.1	170.8	-8.9	24.7	0	0	0	110.5	V951	P949-V951 PolarHBondContact O-N 3.08Å
950	P	25.4	Very low	25.4	Very low	125 Å²	125	156 Å²	156	81%	0.812	81%	0.809	S	S	*	*			trans	-77.1	110	-174.2	30.3	-31.2	0	0	0	110.6	R952	P950-R952 PolarHBondContact O-N 3.33Å
951	V	28.8	Very low	25.2	Very low	128 Å²	128	154.5 Å²	154.5	78%	0.776	81%	0.81	S	S	*	*			trans	-74.1	109.9	166.3	180	0	0	0	0	107.5	P949 S953	P949-V951 PolarHBondContact O-N 3.08Å; V951-S953 VanDerWaalsContact C-N 3.32Å; V951-S953 PolarHBondContact O-N 3.32Å
952	R	23.1	Very low	24.9	Very low	247 Å²	247	154.2 Å²	154.2	93%	0.932	81%	0.814	S	S	*	*			trans	-64.4	91	168.4	-85.2	179.5	164	177.7	-4.3	109	P950	P950-R952 PolarHBondContact O-N 3.33Å
953	S	26.2	Very low	24.9	Very low	111 Å²	111	154.1 Å²	154.1	78%	0.776	81%	0.814	S	S	*	*			trans	-84.9	109.4	166.2	-67.5	0	0	0	0	109.5	V951	V951-S953 VanDerWaalsContact C-N 3.32Å; V951-S953 PolarHBondContact O-N 3.32Å
954	A	25.9	Very low	24.5	Very low	100 Å²	100	149.1 Å²	149.1	83%	0.826	81%	0.807	S	S	*	*			trans	-95.5	102.2	167	0	0	0	0	0	109.1
955	S	23.4	Very low	24.3	Very low	113 Å²	113	146 Å²	146	79%	0.79	80%	0.803	S	S	*	*			trans	-175.7	125.6	138.5	52.8	0	0	0	0	110.7
956	Y	21.2	Very low	24	Very low	225 Å²	225	146.1 Å²	146.1	88%	0.882	80%	0.8	S	S	*	*			trans	-50.5	132.1	169.5	-74.6	-105.6	0	0	0	112.3
957	I	25.9	Very low	23.9	Very low	163 Å²	163	148.8 Å²	148.8	84%	0.836	81%	0.808	S	S	*	*				177.6	130.1	109.4	-84.6	161.1	0	0	0	108.4
958	S	21.7	Very low	23.7	Very low	112 Å²	112	146.8 Å²	146.8	78%	0.783	81%	0.807	S	S	*	*			trans	-66.1	140.3	175.7	-43.6	0	0	0	0	113.2
959	A	24	Very low	24.2	Very low	93 Å²	93	140.4 Å²	140.4	77%	0.769	80%	0.797	S	S	*	*				172.5	111.6	124.2	0	0	0	0	0	112.6
960	S	21.8	Very low	24	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	81%	0.806	S	S	*	*			trans	35.9	113.7	136.1	61.6	0	0	0	0	122.5
961	S	21.6	Very low	23.7	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	80%	0.804	S	S	*	*				82.4	134.4	110.3	-53.7	0	0	0	0	122.7
962	T	23.2	Very low	23.3	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	81%	0.807	S	S	*	*			trans	99.5	103.1	149.5	52.7	0	0	0	0	121.5
963	N	23	Very low	23.3	Very low	152 Å²	152	133.9 Å²	133.9	81%	0.813	80%	0.8	S	S	*	*				65.6	114.9	118.1	-76	-5.8	0	0	0	122.3
964	A	24.8	Very low	23.1	Very low	84 Å²	84	133.2 Å²	133.2	69%	0.694	80%	0.796	S	S	*	*				106.7	132.9	106.8	0	0	0	0	0	120.5
965	Q	20.9	Very low	23	Very low	171 Å²	171	133.8 Å²	133.8	80%	0.799	79%	0.793	S	S	*	*			trans	76.1	110.8	147	-73.5	-174.1	-6.7	0	0	118.2
966	K	20.4	Very low	23	Very low	186 Å²	186	135 Å²	135	81%	0.809	80%	0.796	S	S	*	*				69.5	111.1	83.4	-85.8	-171.4	177.7	-179.6	0	111.5
967	E	22.7	Very low	23.1	Very low	200 Å²	200	133.3 Å²	133.3	94%	0.935	80%	0.796	S	S	*	*				-173.6	168.1	128.8	-104.7	176.3	-164.8	0	0	113
968	Q	21.1	Very low	22.9	Very low	189 Å²	189	130.2 Å²	130.2	88%	0.883	79%	0.789	S	S	*	*			trans	-110.9	179.9	-145.4	-107.7	-154.9	-6.2	0	0	113.3
969	P	35.9	Very low	23	Very low	110 Å²	110	132.5 Å²	132.5	71%	0.714	79%	0.791	S	S	*	*			trans	-104.8	168.4	-147.9	40.9	-36.1	0	0	0	115.7
970	V	22.1	Very low	23	Very low	147 Å²	147	135.5 Å²	135.5	89%	0.891	80%	0.795	S	S	*	*			trans	-141.3	155.6	166.1	-141.3	0	0	0	0	111.7
971	S	20.6	Very low	23.2	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	80%	0.804	S	S	*	*			trans	-87.9	161.9	-154.6	-45.9	0	0	0	0	117.4
972	A	20.8	Very low	23.2	Very low	100 Å²	100	142.6 Å²	142.6	83%	0.826	81%	0.809	S	S	*	*			trans	61.4	120.1	140.5	0	0	0	0	0	121.1
973	S	21.8	Very low	23.3	Very low	114 Å²	114	142.7 Å²	142.7	80%	0.797	81%	0.81	S	S	*	*				164.2	149.1	115.6	-173.3	0	0	0	0	112.2
974	S	22.4	Very low	23.3	Very low	98 Å²	98	145 Å²	145	69%	0.685	82%	0.816	S	S	*	*			trans	-36.9	138	173.7	50.5	0	0	0	0	118.2
975	S	23.3	Very low	23.2	Very low	111 Å²	111	148.1 Å²	148.1	78%	0.776	82%	0.819	S	S	*	*				163.8	137.7	118.7	-73.4	0	0	0	0	111	Q977	S975-Q977 PolarHBondContact O-N 2.98Å
976	V	23.4	Very low	23.4	Very low	140 Å²	140	144.3 Å²	144.3	85%	0.848	82%	0.817	S	S	*	*			trans	-18.6	115.6	167.9	-173.2	0	0	0	0	115.4
977	Q	24.1	Very low	23.4	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	82%	0.816	S	S	*	*			trans	-168	132.5	132.1	-105.1	167	9.2	0	0	111.1	S975	S975-Q977 PolarHBondContact O-N 2.98Å
978	S	22.4	Very low	23.4	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	81%	0.807	S	S	*	*			trans	-60.6	157.6	-178.8	-45.7	0	0	0	0	113.5
979	L	23.5	Very low	23.5	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	80%	0.799	S	S	*	*			trans	65.2	92.8	152.2	-65.6	155.5	0	0	0	116.6
980	N	23.8	Very low	22.9	Very low	156 Å²	156	137.1 Å²	137.1	83%	0.834	81%	0.807	S	S	*	*			trans	-169.7	78.1	136.5	-95.8	-12.6	0	0	0	110.4	L982	N980-L982 VanDerWaalsContact C-N 3.33Å; N980-L982 PolarHBondContact O-N 3.14Å
981	E	24.6	Very low	23	Very low	194 Å²	194	139.6 Å²	139.6	91%	0.907	81%	0.806	S	S	*	*			trans	-90.8	68.3	158	-84.6	-173.1	153.5	0	0	108.7
982	L	22.7	Very low	23	Very low	164 Å²	164	139.4 Å²	139.4	86%	0.859	80%	0.804	S	S	*	*			trans	-153.5	88	159.3	-79.6	-175.6	0	0	0	108.8	N980	N980-L982 VanDerWaalsContact C-N 3.33Å; N980-L982 PolarHBondContact O-N 3.14Å
983	T	24.5	Very low	23.1	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	81%	0.805	S	S	*	*			trans	-137.3	84.3	162.7	9.1	0	0	0	0	108.9
984	E	22.9	Very low	23.2	Very low	201 Å²	201	140 Å²	140	94%	0.939	80%	0.802	S	S	*	*			trans	-95.4	122.6	140.2	-92	-177.1	169.9	0	0	106.8
985	I	22.4	Very low	23.3	Very low	149 Å²	149	143.4 Å²	143.4	76%	0.764	81%	0.813	S	S	*	*			trans	-74.2	130.2	-176.4	-66.3	163.8	0	0	0	109.6
986	A	25.4	Very low	23.4	Very low	90 Å²	90	144.2 Å²	144.2	74%	0.744	82%	0.818	S	S	*	*			trans	-159.9	81.4	134.8	0	0	0	0	0	109.3	P988	A986-P988 WeakPolarHBondContact O-CD 3.41Å
987	T	21	Very low	23.6	Very low	131 Å²	131	141.1 Å²	141.1	80%	0.804	81%	0.814	S	S	*	*			trans	-77.3	131.8	163.7	46.6	0	0	0	0	109.8
988	P	23.4	Very low	23.7	Very low	114 Å²	114	140.2 Å²	140.2	74%	0.74	81%	0.81	S	S	*	*			trans	-116.9	116.2	134	20.1	-4.6	0	0	0	110	A986	A986-P988 WeakPolarHBondContact O-CD 3.41Å
989	S	23	Very low	23.9	Very low	102 Å²	102	142 Å²	142	71%	0.713	81%	0.812	S	S	*	*			trans	29.1	109.2	146.6	59.8	0	0	0	0	118.9
990	E	23	Very low	24.2	Very low	187 Å²	187	137.1 Å²	137.1	87%	0.874	80%	0.8	S	S	*	*				29.2	107	127.8	-64.5	-176	161.2	0	0	118
991	K	24.2	Very low	24.4	Very low	200 Å²	200	137.7 Å²	137.7	87%	0.87	80%	0.797	S	S	*	*				-166.3	111.1	128.9	-101.9	161.5	-171.2	-178	0	109.9
992	S	21.1	Very low	24.7	Very low	104 Å²	104	133 Å²	133	73%	0.727	78%	0.778	S	S	*	*			trans	21	120	145.3	57	0	0	0	0	118.3
993	T	22.8	Very low	25.2	Very low	138 Å²	138	129.1 Å²	129.1	85%	0.847	77%	0.765	S	S	*	*				161.4	148.6	90.9	-32.8	0	0	0	0	109
994	A	22.6	Very low	25.9	Very low	88 Å²	88	127 Å²	127	73%	0.727	75%	0.751	S	S	*	*			trans	-49.8	133.8	-173.2	0	0	0	0	0	116.9
995	N	25.9	Very low	26.6	Very low	171 Å²	171	123.2 Å²	123.2	91%	0.914	73%	0.728	S	S	*	*			trans	-157.6	97.9	142.5	-102.4	-10.6	0	0	0	109.3
996	S	24.7	Very low	27.6	Very low	127 Å²	127	122.3 Å²	122.3	89%	0.888	72%	0.719	S	S	*	*			trans	-79.7	122.6	174.6	33.1	0	0	0	0	110.5
997	G	28.1	Very low	28.9	Very low	75 Å²	75	123.9 Å²	123.9	77%	0.773	71%	0.709	S	S	*	*	S	Bend	trans	163.3	-12.3	165.1	0	0	0	0	0	120.9
998	Q	25.3	Very low	30.1	Very low	169 Å²	169	123.3 Å²	123.3	79%	0.79	70%	0.699	S	S	*	*	S	Bend	trans	-121.1	-3.4	-171.5	-73.4	-170.7	-11.8	0	0	117.7	G1000	Q998-G1000 PolarHBondContact O-N 3.19Å
999	D	26.5	Very low	31.4	Very low	138 Å²	138	122.8 Å²	122.8	74%	0.738	69%	0.688	S	S	*	*	H	α-helix	trans	-78.9	-20.6	-171.9	-70.2	-34.6	0	0	0	116	Q1001	D999-Q1001 PolarHBondContact O-N 3.46Å
1000	G	30.7	Very low	33.3	Very low	55 Å²	55	126.6 Å²	126.6	57%	0.567	69%	0.687	S	S	*	*	H	α-helix	trans	-71.2	-30.8	-177.1	0	0	0	0	0	115.1	Q998 T1004	Q998-G1000 PolarHBondContact O-N 3.19Å; G1000-T1004 PolarHBondContact O-N 3.48Å; G1000-T1004 PolarHBondContact O-OG1 3.16Å
1001	Q	27.5	Very low	35.5	Very low	168 Å²	168	120.1 Å²	120.1	79%	0.785	66%	0.656	S	S	*	*	H	α-helix	trans	-80.2	-36.6	-177	-76.1	-173.9	-8.1	0	0	112.9	D999 T1004 R1005	D999-Q1001 PolarHBondContact O-N 3.46Å; Q1001-T1004 PolarHBondContact O-N 3.24Å; Q1001-R1005 WeakPolarHBondContact O-CB 3.47Å; Q1001-R1005 PolarHBondContact O-N 2.89Å
1002	L	30.3	Very low	37.7	Very low	97 Å²	97	112.7 Å²	112.7	51%	0.508	63%	0.626	S	S	.	*	H	α-helix	trans	-63.8	-46.7	176.4	-81.3	158.1	0	0	0	110.7	T1004 R1005 F1006	L1002-T1004 PolarHBondContact O-N 2.83Å; L1002-R1005 PolarHBondContact O-N 2.84Å; L1002-F1006 HydrophobicContact CB-CD2 4.45Å; L1002-F1006 HydrophobicContact CB-CE2 4.38Å; L1002-F1006 HydrophobicContact CD2-CE2 3.94Å; L1002-F1006 WeakPolarHBondContact O-CD2 3.29Å; L1002-F1006 PolarHBondContact O-N 3.12Å
1003	S	34.2	Very low	40.3	Very low	82 Å²	82	114.3 Å²	114.3	57%	0.573	62%	0.617	S	S	*	*	H	α-helix	trans	-58	-45.5	177.2	-179.1	0	0	0	0	112.4	R1005 F1006 F1007	S1003-R1005 PolarHBondContact O-N 3Å; S1003-F1006 PolarHBondContact O-N 2.82Å; S1003-F1007 VanDerWaalsContact O-CB 3.32Å; S1003-F1007 WeakPolarHBondContact O-CB 3.28Å; S1003-F1007 PolarHBondContact O-N 2.88Å
1004	T	39.2	Very low	42.9	Very low	80 Å²	80	110.2 Å²	110.2	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-65.5	-40.1	177.6	-51.9	0	0	0	0	111.9	G1000 Q1001 L1002 F1007 M1008	G1000-T1004 PolarHBondContact O-N 3.48Å; G1000-T1004 PolarHBondContact O-OG1 3.16Å; Q1001-T1004 PolarHBondContact O-N 3.24Å; L1002-T1004 PolarHBondContact O-N 2.83Å; T1004-F1007 PolarHBondContact O-N 3.06Å; T1004-M1008 HydrophobicContact CG2-SD 4.36Å; T1004-M1008 WeakPolarHBondContact O-CB 3.37Å; T1004-M1008 VanDerWaalsContact O-CG 3.28Å; T1004-M1008 WeakPolarHBondContact O-CG 3.36Å; T1004-M1008 PolarHBondContact O-N 3.41Å
1005	R	37.6	Very low	45.5	Very low	122 Å²	122	106.8 Å²	106.8	46%	0.46	56%	0.556	S	S	.	*	H	α-helix	trans	-67.5	-41.6	178.8	-162.4	179.4	-177.6	171.3	0.3	112	Q1001 L1002 S1003 M1008 M1009 Y1158	Q1001-R1005 WeakPolarHBondContact O-CB 3.47Å; Q1001-R1005 PolarHBondContact O-N 2.89Å; L1002-R1005 PolarHBondContact O-N 2.84Å; S1003-R1005 PolarHBondContact O-N 3Å; R1005-M1008 PolarHBondContact O-N 2.77Å; R1005-M1009 HydrophobicContact CG-CE 4.43Å; R1005-M1009 WeakPolarHBondContact O-CG 3.43Å; R1005-M1009 PolarHBondContact O-N 2.81Å; R1005-Y1158 VanDerWaalsContact CZ-OH 3.3Å; R1005-Y1158 PolarHBondContact NE-OH 3.47Å; R1005-Y1158 PolarHBondContact NH2-OH 3.35Å; R1005-Y1158 VanDerWaalsContact NH2-OH 3.16Å
1006	F	42.9	Very low	48.2	Very low	131 Å²	131	100.1 Å²	100.1	58%	0.575	52%	0.518	S	S	*	.	H	α-helix	trans	-65.3	-40.2	173.1	-77	-66.7	0	0	0	111.9	L1002 S1003 M1009 R1010	L1002-F1006 HydrophobicContact CB-CD2 4.45Å; L1002-F1006 HydrophobicContact CB-CE2 4.38Å; L1002-F1006 HydrophobicContact CD2-CE2 3.94Å; L1002-F1006 WeakPolarHBondContact O-CD2 3.29Å; L1002-F1006 PolarHBondContact O-N 3.12Å; S1003-F1006 PolarHBondContact O-N 2.82Å; F1006-M1009 HydrophobicContact CD1-CE 3.6Å; F1006-M1009 HydrophobicContact CE1-CE 3.88Å; F1006-M1009 HydrophobicContact CG-CE 4.27Å; F1006-M1009 PolarHBondContact O-N 3.39Å; F1006-R1010 WeakPolarHBondContact O-CB 3.49Å; F1006-R1010 PolarHBondContact O-N 3.33Å
1007	F	53	Low	50.9	Low	122 Å²	122	97.2 Å²	97.2	54%	0.535	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-44	173.6	-177.9	-95.6	0	0	0	111.8	S1003 T1004 R1010 K1011	S1003-F1007 VanDerWaalsContact O-CB 3.32Å; S1003-F1007 WeakPolarHBondContact O-CB 3.28Å; S1003-F1007 PolarHBondContact O-N 2.88Å; T1004-F1007 PolarHBondContact O-N 3.06Å; F1007-R1010 PolarHBondContact O-N 3.14Å; F1007-K1011 HydrophobicContact CD1-CG 4.27Å; F1007-K1011 HydrophobicContact CE1-CG 3.92Å; F1007-K1011 HydrophobicContact CZ-CD 4.4Å; F1007-K1011 HydrophobicContact CZ-CG 4.06Å; F1007-K1011 WeakPolarHBondContact O-CG 3.43Å; F1007-K1011 PolarHBondContact O-N 3.28Å
1008	M	46.3	Very low	53.5	Low	120 Å²	120	95.5 Å²	95.5	59%	0.591	47%	0.467	S	S	*	.	H	α-helix	trans	-62.7	-45	175.6	-74.6	175.5	68.9	0	0	112.3	T1004 R1005 R1010 K1011 D1012	T1004-M1008 HydrophobicContact CG2-SD 4.36Å; T1004-M1008 WeakPolarHBondContact O-CB 3.37Å; T1004-M1008 VanDerWaalsContact O-CG 3.28Å; T1004-M1008 WeakPolarHBondContact O-CG 3.36Å; T1004-M1008 PolarHBondContact O-N 3.41Å; R1005-M1008 PolarHBondContact O-N 2.77Å; M1008-R1010 PolarHBondContact O-N 3.43Å; M1008-K1011 PolarHBondContact O-N 2.98Å; M1008-D1012 PolarHBondContact O-N 3Å
1009	M	51.4	Low	56.4	Low	103 Å²	103	87.4 Å²	87.4	51%	0.507	43%	0.43	S	S	.	.	H	α-helix	trans	-62.6	-41.6	177.6	-75	-171.7	-70.7	0	0	111.9	R1005 F1006 D1012 Y1013	R1005-M1009 HydrophobicContact CG-CE 4.43Å; R1005-M1009 WeakPolarHBondContact O-CG 3.43Å; R1005-M1009 PolarHBondContact O-N 2.81Å; F1006-M1009 HydrophobicContact CD1-CE 3.6Å; F1006-M1009 HydrophobicContact CE1-CE 3.88Å; F1006-M1009 HydrophobicContact CG-CE 4.27Å; F1006-M1009 PolarHBondContact O-N 3.39Å; M1009-D1012 PolarHBondContact O-N 3.48Å; M1009-Y1013 PolarHBondContact O-N 3.3Å
1010	R	61.7	Low	59.2	Low	182 Å²	182	81.3 Å²	81.3	69%	0.687	40%	0.398	S	S	*	.	H	α-helix	trans	-63.1	-43.1	176	-169.9	175.5	-177.5	158.8	5	111.7	F1006 F1007 M1008 Y1013 E1014	F1006-R1010 WeakPolarHBondContact O-CB 3.49Å; F1006-R1010 PolarHBondContact O-N 3.33Å; F1007-R1010 PolarHBondContact O-N 3.14Å; M1008-R1010 PolarHBondContact O-N 3.43Å; R1010-Y1013 PolarHBondContact O-N 3.08Å; R1010-E1014 IonicContact NE-OE1 3.91Å; R1010-E1014 WeakPolarHBondContact O-CG 3.21Å; R1010-E1014 PolarHBondContact O-N 2.76Å
1011	K	70.6	Confident	61.8	Low	51 Å²	51	81.2 Å²	81.2	22%	0.222	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-35	176.7	-70.4	-71.2	164.8	-149.5	0	113	F1007 M1008 E1014 R1015	F1007-K1011 HydrophobicContact CD1-CG 4.27Å; F1007-K1011 HydrophobicContact CE1-CG 3.92Å; F1007-K1011 HydrophobicContact CZ-CD 4.4Å; F1007-K1011 HydrophobicContact CZ-CG 4.06Å; F1007-K1011 WeakPolarHBondContact O-CG 3.43Å; F1007-K1011 PolarHBondContact O-N 3.28Å; M1008-K1011 PolarHBondContact O-N 2.98Å; K1011-E1014 WeakPolarHBondContact CD-OE2 3.41Å; K1011-E1014 IonicContact NZ-OE1 3.45Å; K1011-E1014 IonicContact NZ-OE2 3.57Å; K1011-E1014 PolarHBondContact NZ-OE2 3.11Å; K1011-R1015 VanDerWaalsContact O-CD 3.28Å; K1011-R1015 WeakPolarHBondContact O-CD 3.36Å; K1011-R1015 WeakPolarHBondContact O-CG 3.43Å; K1011-R1015 PolarHBondContact O-N 3.45Å; K1011-R1015 VanDerWaalsContact O-N 3.12Å
1012	D	69.4	Low	64.6	Low	43 Å²	43	73.8 Å²	73.8	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-43	173.8	-167.7	49.3	0	0	0	110.9	M1008 M1009 R1015 R1016 K1068	M1008-D1012 PolarHBondContact O-N 3Å; M1009-D1012 PolarHBondContact O-N 3.48Å; D1012-R1015 PolarHBondContact O-N 2.85Å; D1012-R1016 VanDerWaalsContact CG-NE 3.32Å; D1012-R1016 VanDerWaalsContact O-CG 3.26Å; D1012-R1016 WeakPolarHBondContact O-CG 3.38Å; D1012-R1016 PolarHBondContact O-N 3.21Å; D1012-R1016 IonicContact OD1-CZ 3.14Å; D1012-R1016 IonicContact OD1-NE 3.75Å; D1012-R1016 PolarHBondContact OD1-NE 2.97Å; D1012-R1016 IonicContact OD1-NH2 2.66Å; D1012-R1016 PolarHBondContact OD1-NH2 3.21Å; D1012-R1016 IonicContact OD2-CZ 2.77Å; D1012-R1016 IonicContact OD2-NE 3.32Å; D1012-R1016 PolarHBondContact OD2-NE 2.92Å; D1012-R1016 IonicContact OD2-NH2 2.73Å; D1012-R1016 PolarHBondContact OD2-NH2 3.46Å; D1012-K1068 IonicContact OD2-NZ 2.67Å; D1012-K1068 PolarHBondContact OD2-NZ 3.35Å
1013	Y	75.8	Confident	67.3	Low	138 Å²	138	69.2 Å²	69.2	54%	0.541	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-49.9	173.4	-178.6	-88.8	0	0	0	111.8	M1009 R1010 R1015 R1016 D1017	M1009-Y1013 PolarHBondContact O-N 3.3Å; R1010-Y1013 PolarHBondContact O-N 3.08Å; Y1013-R1015 VanDerWaalsContact C-N 3.26Å; Y1013-R1015 PolarHBondContact O-N 3.14Å; Y1013-R1016 PolarHBondContact O-N 2.77Å; Y1013-R1016 VanDerWaalsContact O-N 3.13Å; Y1013-D1017 HydrophobicContact CD1-CB 4.45Å; Y1013-D1017 HydrophobicContact CE1-CB 4.14Å; Y1013-D1017 VanDerWaalsContact O-CB 3.27Å; Y1013-D1017 WeakPolarHBondContact O-CB 3.38Å; Y1013-D1017 PolarHBondContact O-N 2.96Å
1014	E	76.6	Confident	69.8	Low	53 Å²	53	70.1 Å²	70.1	25%	0.248	33%	0.328	C	S	.	.	H	α-helix	trans	-55.7	-39.7	178.4	-75.3	172.8	-164.7	0	0	112.3	R1010 K1011 T1018 W1118	R1010-E1014 IonicContact NE-OE1 3.91Å; R1010-E1014 WeakPolarHBondContact O-CG 3.21Å; R1010-E1014 PolarHBondContact O-N 2.76Å; K1011-E1014 WeakPolarHBondContact CD-OE2 3.41Å; K1011-E1014 IonicContact NZ-OE1 3.45Å; K1011-E1014 IonicContact NZ-OE2 3.57Å; K1011-E1014 PolarHBondContact NZ-OE2 3.11Å; E1014-T1018 WeakPolarHBondContact O-CB 3.1Å; E1014-T1018 PolarHBondContact O-N 3.08Å; E1014-T1018 PolarHBondContact O-OG1 3.06Å; E1014-W1118 HydrophobicContact CB-CH2 4.1Å
1015	R	77.8	Confident	72	Confident	16 Å²	16	73.1 Å²	73.1	6%	0.06	34%	0.336	C	S	.	.	H	α-helix	trans	-70.8	-41.5	178	-68.6	162.1	-175	175.1	8.6	111.9	Y804 K1011 D1012 Y1013 T1018 L1019 W1118 S1121 L1122 L1125	Y804-R1015 PolarHBondContact O-NH2 3.37Å; Y804-R1015 VanDerWaalsContact O-NH2 3.08Å; K1011-R1015 VanDerWaalsContact O-CD 3.28Å; K1011-R1015 WeakPolarHBondContact O-CD 3.36Å; K1011-R1015 WeakPolarHBondContact O-CG 3.43Å; K1011-R1015 PolarHBondContact O-N 3.45Å; K1011-R1015 VanDerWaalsContact O-N 3.12Å; D1012-R1015 PolarHBondContact O-N 2.85Å; Y1013-R1015 VanDerWaalsContact C-N 3.26Å; Y1013-R1015 PolarHBondContact O-N 3.14Å; R1015-T1018 PolarHBondContact O-N 3.07Å; R1015-L1019 WeakPolarHBondContact O-CB 3.38Å; R1015-L1019 PolarHBondContact O-N 3.23Å; R1015-W1118 HydrophobicContact CG-CD2 4.06Å; R1015-W1118 HydrophobicContact CG-CE3 4.22Å; R1015-W1118 HydrophobicContact CG-CG 4.37Å; R1015-S1121 PolarHBondContact NH1-OG 2.94Å; R1015-L1122 HydrophobicContact CB-CD2 4.1Å; R1015-L1122 WeakPolarHBondContact O-CD2 3.45Å; R1015-L1125 HydrophobicContact CB-CD1 4.24Å
1016	R	83.2	Confident	74.3	Confident	30 Å²	30	69 Å²	69	11%	0.113	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-44.2	176.2	-72.6	167.5	-174.4	-68.7	-19.3	111.7	D1012 Y1013 T1018 L1019 S1020 V1065 L1125	D1012-R1016 VanDerWaalsContact CG-NE 3.32Å; D1012-R1016 VanDerWaalsContact O-CG 3.26Å; D1012-R1016 WeakPolarHBondContact O-CG 3.38Å; D1012-R1016 PolarHBondContact O-N 3.21Å; D1012-R1016 IonicContact OD1-CZ 3.14Å; D1012-R1016 IonicContact OD1-NE 3.75Å; D1012-R1016 PolarHBondContact OD1-NE 2.97Å; D1012-R1016 IonicContact OD1-NH2 2.66Å; D1012-R1016 PolarHBondContact OD1-NH2 3.21Å; D1012-R1016 IonicContact OD2-CZ 2.77Å; D1012-R1016 IonicContact OD2-NE 3.32Å; D1012-R1016 PolarHBondContact OD2-NE 2.92Å; D1012-R1016 IonicContact OD2-NH2 2.73Å; D1012-R1016 PolarHBondContact OD2-NH2 3.46Å; Y1013-R1016 PolarHBondContact O-N 2.77Å; Y1013-R1016 VanDerWaalsContact O-N 3.13Å; R1016-T1018 VanDerWaalsContact C-N 3.32Å; R1016-L1019 PolarHBondContact O-N 3.37Å; R1016-S1020 WeakPolarHBondContact O-CB 3.47Å; R1016-S1020 PolarHBondContact O-N 3Å; R1016-V1065 HydrophobicContact CB-CG1 4Å; R1016-V1065 WeakPolarHBondContact CD-O 3.37Å; R1016-V1065 HydrophobicContact CG-CG1 4.11Å; R1016-V1065 VanDerWaalsContact CG-O 3.27Å; R1016-V1065 WeakPolarHBondContact CG-O 3.38Å; R1016-V1065 PolarHBondContact NH1-O 3.44Å; R1016-L1125 HydrophobicContact CG-CD1 3.88Å; R1016-L1125 HydrophobicContact CG-CD2 4.08Å
1017	D	80.8	Confident	76.5	Confident	67 Å²	67	64.9 Å²	64.9	36%	0.358	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-41.5	175	-172.1	63.4	0	0	0	111	Y1013 S1020 S1021	Y1013-D1017 HydrophobicContact CD1-CB 4.45Å; Y1013-D1017 HydrophobicContact CE1-CB 4.14Å; Y1013-D1017 VanDerWaalsContact O-CB 3.27Å; Y1013-D1017 WeakPolarHBondContact O-CB 3.38Å; Y1013-D1017 PolarHBondContact O-N 2.96Å; D1017-S1020 PolarHBondContact O-N 3.13Å; D1017-S1021 VanDerWaalsContact O-CB 3.24Å; D1017-S1021 WeakPolarHBondContact O-CB 3.44Å; D1017-S1021 PolarHBondContact O-N 2.95Å; D1017-S1021 PolarHBondContact O-OG 3.25Å
1018	T	82.8	Confident	78	Confident	38 Å²	38	63.8 Å²	63.8	23%	0.233	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-47.4	173.6	-57.7	0	0	0	0	111.9	E1014 R1015 R1016 S1020 S1021 I1022 W1118	E1014-T1018 WeakPolarHBondContact O-CB 3.1Å; E1014-T1018 PolarHBondContact O-N 3.08Å; E1014-T1018 PolarHBondContact O-OG1 3.06Å; R1015-T1018 PolarHBondContact O-N 3.07Å; R1016-T1018 VanDerWaalsContact C-N 3.32Å; T1018-S1020 VanDerWaalsContact C-N 3.34Å; T1018-S1020 PolarHBondContact O-N 2.92Å; T1018-S1021 PolarHBondContact O-N 3.42Å; T1018-I1022 HydrophobicContact CG2-CD1 4.02Å; T1018-I1022 VanDerWaalsContact O-CG1 3.3Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.32Å; T1018-I1022 PolarHBondContact O-N 2.98Å; T1018-W1118 HydrophobicContact CG2-CZ3 4.39Å; T1018-W1118 WeakPolarHBondContact OG1-CZ3 3.4Å
1019	L	86.1	Confident	79.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-45.2	177.5	-170.5	57.8	0	0	0	111	R1015 R1016 S1021 I1022 M1023 V1065 M1105 L1109 L1122 L1125	R1015-L1019 WeakPolarHBondContact O-CB 3.38Å; R1015-L1019 PolarHBondContact O-N 3.23Å; R1016-L1019 PolarHBondContact O-N 3.37Å; L1019-S1021 VanDerWaalsContact C-N 3.35Å; L1019-S1021 PolarHBondContact O-N 3.49Å; L1019-I1022 PolarHBondContact O-N 3.13Å; L1019-M1023 HydrophobicContact CG-SD 4Å; L1019-M1023 WeakPolarHBondContact O-CB 3.24Å; L1019-M1023 VanDerWaalsContact O-CG 3.23Å; L1019-M1023 WeakPolarHBondContact O-CG 3.41Å; L1019-M1023 PolarHBondContact O-N 3.38Å; L1019-V1065 HydrophobicContact CB-CG1 4.21Å; L1019-V1065 HydrophobicContact CD2-CG1 4Å; L1019-V1065 HydrophobicContact CD2-CG2 4.18Å; L1019-V1065 HydrophobicContact CG-CG1 4.4Å; L1019-M1105 HydrophobicContact CD1-CE 3.42Å; L1019-M1105 VanDerWaalsContact CD1-CE 3.42Å; L1019-M1105 HydrophobicContact CG-CE 4.44Å; L1019-L1109 HydrophobicContact CD1-CD1 4.42Å; L1019-L1109 HydrophobicContact CD1-CD2 4.07Å; L1019-L1122 HydrophobicContact CB-CD2 3.81Å; L1019-L1122 HydrophobicContact CD1-CB 4.31Å; L1019-L1122 HydrophobicContact CD1-CD2 4.44Å; L1019-L1125 HydrophobicContact CD2-CB 3.56Å; L1019-L1125 HydrophobicContact CD2-CD1 4.33Å
1020	S	85.4	Confident	81.6	Confident	10 Å²	10	57.2 Å²	57.2	7%	0.07	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-41.8	177.4	173.9	0	0	0	0	111.9	R1016 D1017 T1018 M1023 L1024 R1062 I1066	R1016-S1020 WeakPolarHBondContact O-CB 3.47Å; R1016-S1020 PolarHBondContact O-N 3Å; D1017-S1020 PolarHBondContact O-N 3.13Å; T1018-S1020 VanDerWaalsContact C-N 3.34Å; T1018-S1020 PolarHBondContact O-N 2.92Å; S1020-M1023 PolarHBondContact O-N 3.11Å; S1020-L1024 WeakPolarHBondContact O-CB 3.4Å; S1020-L1024 PolarHBondContact O-N 3.46Å; S1020-R1062 WeakPolarHBondContact O-CD 3.28Å; S1020-R1062 WeakPolarHBondContact OG-CD 3.36Å; S1020-R1062 WeakPolarHBondContact OG-CG 3.43Å; S1020-I1066 WeakPolarHBondContact OG-CD1 3.4Å
1021	S	85.2	Confident	82.8	Confident	53 Å²	53	48.7 Å²	48.7	37%	0.371	24%	0.239	S	C	.	.	H	α-helix	trans	-63	-43.1	175.8	-62.7	0	0	0	0	111	D1017 T1018 L1019 L1024 E1025	D1017-S1021 VanDerWaalsContact O-CB 3.24Å; D1017-S1021 WeakPolarHBondContact O-CB 3.44Å; D1017-S1021 PolarHBondContact O-N 2.95Å; D1017-S1021 PolarHBondContact O-OG 3.25Å; T1018-S1021 PolarHBondContact O-N 3.42Å; L1019-S1021 VanDerWaalsContact C-N 3.35Å; L1019-S1021 PolarHBondContact O-N 3.49Å; S1021-L1024 PolarHBondContact O-N 2.76Å; S1021-E1025 VanDerWaalsContact O-CB 3.28Å; S1021-E1025 WeakPolarHBondContact O-CB 3.34Å; S1021-E1025 PolarHBondContact O-N 3.48Å
1022	I	86	Confident	83.4	Confident	11 Å²	11	49.9 Å²	49.9	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-43.1	175.3	-67.3	169.3	0	0	0	111	T1018 L1019 L1024 E1025 F1026 V1108 L1109 Q1112 I1114	T1018-I1022 HydrophobicContact CG2-CD1 4.02Å; T1018-I1022 VanDerWaalsContact O-CG1 3.3Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.32Å; T1018-I1022 PolarHBondContact O-N 2.98Å; L1019-I1022 PolarHBondContact O-N 3.13Å; I1022-L1024 PolarHBondContact O-N 3.17Å; I1022-E1025 PolarHBondContact O-N 3.31Å; I1022-F1026 HydrophobicContact CG2-CD2 3.91Å; I1022-F1026 WeakPolarHBondContact O-CD2 3.23Å; I1022-F1026 PolarHBondContact O-N 3.28Å; I1022-V1108 HydrophobicContact CG2-CG1 4.16Å; I1022-L1109 HydrophobicContact CD1-CD2 3.76Å; I1022-L1109 HydrophobicContact CG2-CD2 4.33Å; I1022-Q1112 HydrophobicContact CD1-CG 4.33Å; I1022-I1114 HydrophobicContact CD1-CD1 3.72Å; I1022-I1114 HydrophobicContact CD1-CG1 4.3Å
1023	M	87.5	Confident	84.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-28	176.5	-70.7	170	78.7	0	0	112.7	L1019 S1020 E1027 L1058 M1061 R1062 V1065 F1101 M1105	L1019-M1023 HydrophobicContact CG-SD 4Å; L1019-M1023 WeakPolarHBondContact O-CB 3.24Å; L1019-M1023 VanDerWaalsContact O-CG 3.23Å; L1019-M1023 WeakPolarHBondContact O-CG 3.41Å; L1019-M1023 PolarHBondContact O-N 3.38Å; S1020-M1023 PolarHBondContact O-N 3.11Å; M1023-E1027 WeakPolarHBondContact O-CA 3.31Å; M1023-L1058 HydrophobicContact CB-CD1 4.43Å; M1023-L1058 HydrophobicContact CE-CD1 3.46Å; M1023-L1058 VanDerWaalsContact CE-CD1 3.46Å; M1023-L1058 HydrophobicContact CE-CG 4.4Å; M1023-L1058 HydrophobicContact CG-CD1 4.36Å; M1023-M1061 HydrophobicContact CE-CB 3.8Å; M1023-R1062 HydrophobicContact CB-CG 4.48Å; M1023-R1062 HydrophobicContact CE-CB 4.1Å; M1023-R1062 HydrophobicContact SD-CB 4.46Å; M1023-V1065 HydrophobicContact SD-CG2 4.45Å; M1023-F1101 HydrophobicContact CE-CZ 4.15Å; M1023-M1105 HydrophobicContact CG-CE 3.78Å; M1023-M1105 HydrophobicContact CG-SD 4.12Å
1024	L	86.6	Confident	84.7	Confident	100 Å²	100	43.3 Å²	43.3	52%	0.524	22%	0.222	S	C	.	.	H	α-helix	trans	-84.1	-45.3	175.8	178.7	69.5	0	0	0	112.2	S1020 S1021 I1022	S1020-L1024 WeakPolarHBondContact O-CB 3.4Å; S1020-L1024 PolarHBondContact O-N 3.46Å; S1021-L1024 PolarHBondContact O-N 2.76Å; I1022-L1024 PolarHBondContact O-N 3.17Å
1025	E	85.1	Confident	84.9	Confident	143 Å²	143	41.7 Å²	41.7	67%	0.668	22%	0.215	S	C	*	.	H	α-helix	trans	-68.6	-37.4	-176.7	-174.3	175.3	-173	0	0	111.9	S1021 I1022	S1021-E1025 VanDerWaalsContact O-CB 3.28Å; S1021-E1025 WeakPolarHBondContact O-CB 3.34Å; S1021-E1025 PolarHBondContact O-N 3.48Å; I1022-E1025 PolarHBondContact O-N 3.31Å
1026	F	86.6	Confident	85	Confident	35 Å²	35	45.2 Å²	45.2	15%	0.154	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	26.2	-179.2	-58.5	-84.3	0	0	0	112.2	I1022 D1028 E1029 L1030 V1108 Q1112	I1022-F1026 HydrophobicContact CG2-CD2 3.91Å; I1022-F1026 WeakPolarHBondContact O-CD2 3.23Å; I1022-F1026 PolarHBondContact O-N 3.28Å; F1026-D1028 PolarHBondContact O-N 3.31Å; F1026-E1029 WeakPolarHBondContact CD1-OE2 3.49Å; F1026-E1029 PolarHBondContact O-N 3.48Å; F1026-L1030 HydrophobicContact CB-CD1 4.36Å; F1026-L1030 HydrophobicContact CB-CG 4.34Å; F1026-L1030 VanDerWaalsContact O-CB 3.29Å; F1026-L1030 WeakPolarHBondContact O-CB 3.33Å; F1026-L1030 VanDerWaalsContact O-CG 3.25Å; F1026-L1030 WeakPolarHBondContact O-CG 3.36Å; F1026-L1030 PolarHBondContact O-N 3.11Å; F1026-V1108 HydrophobicContact CB-CG1 4.18Å; F1026-V1108 HydrophobicContact CD2-CG1 4.44Å; F1026-V1108 HydrophobicContact CG-CG1 4.18Å; F1026-Q1112 HydrophobicContact CE2-CG 4.33Å; F1026-Q1112 VanDerWaalsContact CZ-CD 3.48Å
1027	E	88.2	Confident	84.7	Confident	46 Å²	46	45.3 Å²	45.3	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-54.6	-49.7	-174.3	-166.2	-178.7	139.3	0	0	112.5	M1023 V1031 L1058 R1062	M1023-E1027 WeakPolarHBondContact O-CA 3.31Å; E1027-V1031 VanDerWaalsContact O-CG2 3.3Å; E1027-V1031 WeakPolarHBondContact O-CG2 3.31Å; E1027-V1031 PolarHBondContact O-N 2.98Å; E1027-L1058 HydrophobicContact CB-CD2 4.4Å; E1027-L1058 HydrophobicContact CG-CD2 3.69Å; E1027-R1062 IonicContact OE2-NH1 2.69Å; E1027-R1062 PolarHBondContact OE2-NH1 3.34Å
1028	D	85.6	Confident	84.3	Confident	99 Å²	99	43.2 Å²	43.2	53%	0.529	23%	0.232	S	C	.	.	H	α-helix	trans	-68.1	-41.5	-179.5	-71.7	-45.6	0	0	0	112.4	F1026 V1031 D1032 K1055	F1026-D1028 PolarHBondContact O-N 3.31Å; D1028-V1031 PolarHBondContact O-N 3Å; D1028-D1032 WeakPolarHBondContact O-CB 3.25Å; D1028-D1032 PolarHBondContact O-N 3.47Å; D1028-K1055 WeakPolarHBondContact OD1-CE 3.23Å; D1028-K1055 IonicContact OD1-NZ 3.43Å; D1028-K1055 PolarHBondContact OD1-NZ 3.26Å
1029	E	85.5	Confident	83.6	Confident	85 Å²	85	48.1 Å²	48.1	40%	0.397	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-42.1	178.2	-175.3	-179.9	172.3	0	0	111.3	F1026 D1032 L1033	F1026-E1029 WeakPolarHBondContact CD1-OE2 3.49Å; F1026-E1029 PolarHBondContact O-N 3.48Å; E1029-D1032 PolarHBondContact O-N 3.25Å; E1029-L1033 HydrophobicContact CG-CD1 3.93Å; E1029-L1033 WeakPolarHBondContact O-CB 3.41Å; E1029-L1033 WeakPolarHBondContact O-CG 3.33Å; E1029-L1033 PolarHBondContact O-N 3.24Å
1030	L	87.2	Confident	82.4	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-48.5	175.1	-77.1	168.6	0	0	0	110.9	F1026 D1032 L1033 W1034 L1058 V1104 M1105 V1108	F1026-L1030 HydrophobicContact CB-CD1 4.36Å; F1026-L1030 HydrophobicContact CB-CG 4.34Å; F1026-L1030 VanDerWaalsContact O-CB 3.29Å; F1026-L1030 WeakPolarHBondContact O-CB 3.33Å; F1026-L1030 VanDerWaalsContact O-CG 3.25Å; F1026-L1030 WeakPolarHBondContact O-CG 3.36Å; F1026-L1030 PolarHBondContact O-N 3.11Å; L1030-D1032 VanDerWaalsContact C-N 3.33Å; L1030-D1032 PolarHBondContact O-N 3.48Å; L1030-L1033 PolarHBondContact O-N 3.25Å; L1030-W1034 WeakPolarHBondContact O-CB 3.29Å; L1030-W1034 PolarHBondContact O-N 3.31Å; L1030-L1058 HydrophobicContact CB-CD2 4.15Å; L1030-L1058 HydrophobicContact CD1-CD2 4.29Å; L1030-V1104 HydrophobicContact CD2-CG1 3.88Å; L1030-M1105 HydrophobicContact CD1-SD 3.68Å; L1030-M1105 HydrophobicContact CD2-CG 4.4Å; L1030-M1105 HydrophobicContact CD2-SD 3.41Å; L1030-M1105 WeakPolarHBondContact CD2-SD 3.43Å; L1030-M1105 HydrophobicContact CG-SD 4.21Å; L1030-V1108 HydrophobicContact CD2-CB 3.93Å; L1030-V1108 HydrophobicContact CD2-CG1 4.34Å; L1030-V1108 HydrophobicContact CD2-CG2 3.5Å; L1030-V1108 HydrophobicContact CG-CG2 4.23Å
1031	V	86.7	Confident	80.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-39.6	179.3	170.9	0	0	0	0	111.4	E1027 D1028 W1034 V1035 K1051 F1054 K1055 L1058	E1027-V1031 VanDerWaalsContact O-CG2 3.3Å; E1027-V1031 WeakPolarHBondContact O-CG2 3.31Å; E1027-V1031 PolarHBondContact O-N 2.98Å; D1028-V1031 PolarHBondContact O-N 3Å; V1031-W1034 PolarHBondContact O-N 3.36Å; V1031-V1035 HydrophobicContact CG1-CG2 4.42Å; V1031-V1035 VanDerWaalsContact O-CG2 3.3Å; V1031-V1035 WeakPolarHBondContact O-CG2 3.29Å; V1031-V1035 PolarHBondContact O-N 3.34Å; V1031-K1051 HydrophobicContact CG1-CB 4.47Å; V1031-F1054 HydrophobicContact CG1-CB 3.87Å; V1031-F1054 HydrophobicContact CG2-CB 4.22Å; V1031-K1055 HydrophobicContact CG2-CG 3.94Å; V1031-L1058 HydrophobicContact CG2-CD2 4.05Å
1032	D	84.4	Confident	79.1	Confident	76 Å²	76	57.3 Å²	57.3	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-43.8	177.5	-81.1	-16	0	0	0	112.7	D1028 E1029 L1030 W1034 T1036 K1051	D1028-D1032 WeakPolarHBondContact O-CB 3.25Å; D1028-D1032 PolarHBondContact O-N 3.47Å; E1029-D1032 PolarHBondContact O-N 3.25Å; L1030-D1032 VanDerWaalsContact C-N 3.33Å; L1030-D1032 PolarHBondContact O-N 3.48Å; D1032-W1034 VanDerWaalsContact C-N 3.28Å; D1032-W1034 PolarHBondContact O-N 2.78Å; D1032-T1036 VanDerWaalsContact O-CB 3.28Å; D1032-T1036 WeakPolarHBondContact O-CB 3.42Å; D1032-T1036 PolarHBondContact O-N 3.43Å; D1032-T1036 PolarHBondContact O-OG1 2.94Å; D1032-K1051 IonicContact OD1-NZ 3.16Å; D1032-K1051 PolarHBondContact OD1-NZ 3.33Å
1033	L	84.5	Confident	77.2	Confident	44 Å²	44	66 Å²	66	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-38.6	172.2	-82.1	158.1	0	0	0	111.5	E1029 L1030 T1036 S1037 V1104 Y1107 V1108	E1029-L1033 HydrophobicContact CG-CD1 3.93Å; E1029-L1033 WeakPolarHBondContact O-CB 3.41Å; E1029-L1033 WeakPolarHBondContact O-CG 3.33Å; E1029-L1033 PolarHBondContact O-N 3.24Å; L1030-L1033 PolarHBondContact O-N 3.25Å; L1033-T1036 PolarHBondContact O-N 3.28Å; L1033-S1037 WeakPolarHBondContact O-CB 3.18Å; L1033-S1037 PolarHBondContact O-N 3.21Å; L1033-S1037 PolarHBondContact O-OG 2.79Å; L1033-V1104 HydrophobicContact CB-CG1 3.68Å; L1033-Y1107 HydrophobicContact CD1-CD1 3.85Å; L1033-Y1107 HydrophobicContact CD1-CE1 4.07Å; L1033-Y1107 HydrophobicContact CD2-CD1 4.14Å; L1033-Y1107 HydrophobicContact CD2-CE1 4.09Å; L1033-V1108 HydrophobicContact CD1-CG2 3.74Å
1034	W	87.4	Confident	75.3	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-67.8	-46.2	-178.6	-159.8	2.5	0	0	0	112.2	L1030 V1031 D1032 T1036 S1037 L1038 F1054 L1057 L1058 M1061 A1097 F1101 V1104	L1030-W1034 WeakPolarHBondContact O-CB 3.29Å; L1030-W1034 PolarHBondContact O-N 3.31Å; V1031-W1034 PolarHBondContact O-N 3.36Å; D1032-W1034 VanDerWaalsContact C-N 3.28Å; D1032-W1034 PolarHBondContact O-N 2.78Å; W1034-T1036 VanDerWaalsContact C-N 3.33Å; W1034-T1036 PolarHBondContact O-N 2.82Å; W1034-S1037 PolarHBondContact O-N 3.46Å; W1034-L1038 PolarHBondContact O-N 3.31Å; W1034-F1054 AromaticContact CD2-CD1 3.68Å; W1034-F1054 HydrophobicContact CD2-CD1 3.68Å; W1034-F1054 HydrophobicContact CD2-CE1 4.05Å; W1034-F1054 AromaticContact CE3-CD1 3.75Å; W1034-F1054 HydrophobicContact CE3-CD1 3.75Å; W1034-F1054 HydrophobicContact CG-CD1 4.1Å; W1034-F1054 HydrophobicContact CG-CE1 4.18Å; W1034-F1054 HydrophobicContact CZ2-CD1 4.43Å; W1034-F1054 HydrophobicContact CZ3-CD1 4.17Å; W1034-L1057 HydrophobicContact CH2-CD2 3.65Å; W1034-L1057 HydrophobicContact CH2-CG 4.11Å; W1034-L1057 HydrophobicContact CZ2-CD2 4.09Å; W1034-L1058 HydrophobicContact CZ3-CB 4.33Å; W1034-M1061 HydrophobicContact CH2-SD 4Å; W1034-A1097 HydrophobicContact CZ2-CB 4.4Å; W1034-A1097 PolarHBondContact NE1-O 3.26Å; W1034-F1101 HydrophobicContact CD2-CB 4.44Å; W1034-F1101 AromaticContact CD2-CD2 3.58Å; W1034-F1101 HydrophobicContact CD2-CD2 3.58Å; W1034-F1101 HydrophobicContact CD2-CE2 4.33Å; W1034-F1101 HydrophobicContact CD2-CG 4.42Å; W1034-F1101 AromaticContact CE2-CD2 3.56Å; W1034-F1101 AromaticContact CE2-CG 3.94Å; W1034-F1101 AromaticContact CE3-CD2 3.55Å; W1034-F1101 HydrophobicContact CE3-CD2 3.55Å; W1034-F1101 AromaticContact CE3-CE2 3.87Å; W1034-F1101 HydrophobicContact CE3-CE2 3.87Å; W1034-F1101 HydrophobicContact CG-CD2 4.35Å; W1034-F1101 HydrophobicContact CH2-CB 4.18Å; W1034-F1101 AromaticContact CH2-CD2 3.55Å; W1034-F1101 HydrophobicContact CH2-CD2 3.55Å; W1034-F1101 HydrophobicContact CH2-CE2 4.07Å; W1034-F1101 AromaticContact CH2-CG 3.87Å; W1034-F1101 HydrophobicContact CH2-CG 3.87Å; W1034-F1101 HydrophobicContact CZ2-CB 3.48Å; W1034-F1101 VanDerWaalsContact CZ2-CB 3.48Å; W1034-F1101 AromaticContact CZ2-CD2 3.59Å; W1034-F1101 HydrophobicContact CZ2-CD2 3.59Å; W1034-F1101 AromaticContact CZ2-CG 3.69Å; W1034-F1101 HydrophobicContact CZ2-CG 3.69Å; W1034-F1101 AromaticContact CZ3-CD2 3.53Å; W1034-F1101 HydrophobicContact CZ3-CD2 3.53Å; W1034-F1101 AromaticContact CZ3-CE2 3.72Å; W1034-F1101 HydrophobicContact CZ3-CE2 3.72Å; W1034-F1101 HydrophobicContact CZ3-CG 4.32Å; W1034-V1104 HydrophobicContact CB-CG1 4.29Å; W1034-V1104 HydrophobicContact CB-CG2 4.24Å; W1034-V1104 HydrophobicContact CG-CG2 4.42Å
1035	V	81.2	Confident	73.7	Confident	19 Å²	19	75 Å²	75	12%	0.115	38%	0.384	C	S	.	.	H	α-helix	trans	-65.5	-36.8	174	172.7	0	0	0	0	111.5	V1031 K1039 K1051 F1054	V1031-V1035 HydrophobicContact CG1-CG2 4.42Å; V1031-V1035 VanDerWaalsContact O-CG2 3.3Å; V1031-V1035 WeakPolarHBondContact O-CG2 3.29Å; V1031-V1035 PolarHBondContact O-N 3.34Å; V1035-K1039 WeakPolarHBondContact O-CG 3.34Å; V1035-K1039 PolarHBondContact O-N 3.03Å; V1035-K1051 HydrophobicContact CG2-CG 4.46Å; V1035-F1054 HydrophobicContact CG2-CD2 3.93Å; V1035-F1054 HydrophobicContact CG2-CE2 3.98Å; V1035-F1054 HydrophobicContact CG2-CG 4.33Å; V1035-F1054 HydrophobicContact CG2-CZ 4.42Å
1036	T	79.7	Confident	72.1	Confident	90 Å²	90	76.6 Å²	76.6	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-68.3	-42	178.3	-57.5	0	0	0	0	111.6	D1032 L1033 W1034 L1038 K1039 S1040	D1032-T1036 VanDerWaalsContact O-CB 3.28Å; D1032-T1036 WeakPolarHBondContact O-CB 3.42Å; D1032-T1036 PolarHBondContact O-N 3.43Å; D1032-T1036 PolarHBondContact O-OG1 2.94Å; L1033-T1036 PolarHBondContact O-N 3.28Å; W1034-T1036 VanDerWaalsContact C-N 3.33Å; W1034-T1036 PolarHBondContact O-N 2.82Å; T1036-L1038 VanDerWaalsContact C-N 3.29Å; T1036-L1038 PolarHBondContact O-N 2.93Å; T1036-K1039 PolarHBondContact O-N 3.36Å; T1036-S1040 PolarHBondContact O-N 3.25Å
1037	S	76.6	Confident	70.7	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.224	40%	0.399	C	S	.	.	H	α-helix	trans	-65	-33.5	178.9	-55.8	0	0	0	0	112	L1033 W1034 K1039 S1040 V1100	L1033-S1037 WeakPolarHBondContact O-CB 3.18Å; L1033-S1037 PolarHBondContact O-N 3.21Å; L1033-S1037 PolarHBondContact O-OG 2.79Å; W1034-S1037 PolarHBondContact O-N 3.46Å; S1037-K1039 VanDerWaalsContact C-N 3.28Å; S1037-K1039 PolarHBondContact O-N 3.32Å; S1037-S1040 PolarHBondContact O-N 3.47Å; S1037-S1040 PolarHBondContact O-OG 2.93Å; S1037-S1040 VanDerWaalsContact O-OG 3.14Å; S1037-V1100 VanDerWaalsContact CB-CG1 3.46Å
1038	L	71.8	Confident	69.4	Low	22 Å²	22	79.1 Å²	79.1	12%	0.115	42%	0.418	C	S	.	.	H	α-helix	trans	-66.4	-27.9	172.2	-79.2	162.2	0	0	0	113.7	W1034 T1036 F1054 F1096 A1097	W1034-L1038 PolarHBondContact O-N 3.31Å; T1036-L1038 VanDerWaalsContact C-N 3.29Å; T1036-L1038 PolarHBondContact O-N 2.93Å; L1038-F1054 HydrophobicContact CD1-CE1 3.59Å; L1038-F1054 HydrophobicContact CD1-CZ 3.35Å; L1038-F1096 HydrophobicContact CD2-CD1 3.43Å; L1038-F1096 VanDerWaalsContact CD2-CD1 3.43Å; L1038-F1096 HydrophobicContact CD2-CE1 3.8Å; L1038-A1097 HydrophobicContact CD1-CB 3.81Å; L1038-A1097 HydrophobicContact CD2-CB 4.24Å
1039	K	68.1	Low	68.8	Low	141 Å²	141	75.3 Å²	75.3	61%	0.613	40%	0.397	S	S	*	.	H	α-helix	trans	-84.4	-23.6	179.2	-70.4	177.9	-179.2	-179.2	0	113.2	V1035 T1036 S1037	V1035-K1039 WeakPolarHBondContact O-CG 3.34Å; V1035-K1039 PolarHBondContact O-N 3.03Å; T1036-K1039 PolarHBondContact O-N 3.36Å; S1037-K1039 VanDerWaalsContact C-N 3.28Å; S1037-K1039 PolarHBondContact O-N 3.32Å
1040	S	61.4	Low	68.4	Low	83 Å²	83	74.3 Å²	74.3	58%	0.58	40%	0.4	S	S	*	.	H	α-helix	trans	-74.7	-30.2	-179.2	67	0	0	0	0	113.2	T1036 S1037	T1036-S1040 PolarHBondContact O-N 3.25Å; S1037-S1040 PolarHBondContact O-N 3.47Å; S1037-S1040 PolarHBondContact O-OG 2.93Å; S1037-S1040 VanDerWaalsContact O-OG 3.14Å
1041	D	50.3	Low	68.1	Low	108 Å²	108	79.2 Å²	79.2	58%	0.578	42%	0.421	S	S	*	.	S	Bend	trans	-94.7	-6.9	-163.6	-77.9	9.3	0	0	0	114.9
1042	V	50	Low	67.9	Low	66 Å²	66	85 Å²	85	40%	0.4	45%	0.448	S	S	.	.			trans	-146	112.7	176.6	-170.6	0	0	0	0	110.7	D1044 Y1045	V1042-D1044 VanDerWaalsContact C-N 3.26Å; V1042-D1044 PolarHBondContact O-N 2.94Å; V1042-D1044 VanDerWaalsContact O-N 3.11Å; V1042-Y1045 HydrophobicContact CB-CD2 4.42Å; V1042-Y1045 HydrophobicContact CG1-CD2 3.91Å
1043	Q	47.2	Very low	67.8	Low	192 Å²	192	81.8 Å²	81.8	90%	0.897	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-10	-169.4	-83.1	-178.4	-14.5	0	0	116.7
1044	D	47.6	Very low	68	Low	163 Å²	163	79.9 Å²	79.9	87%	0.872	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	22.7	-175.8	-80.7	-39.8	0	0	0	114.4	V1042	V1042-D1044 VanDerWaalsContact C-N 3.26Å; V1042-D1044 PolarHBondContact O-N 2.94Å; V1042-D1044 VanDerWaalsContact O-N 3.11Å
1045	Y	51.7	Low	68	Low	128 Å²	128	82.7 Å²	82.7	50%	0.502	43%	0.434	S	S	.	.			trans	-94.3	105.8	-175.5	-130.8	-86.2	0	0	0	112.5	V1042 C1047 Q1093	V1042-Y1045 HydrophobicContact CB-CD2 4.42Å; V1042-Y1045 HydrophobicContact CG1-CD2 3.91Å; Y1045-C1047 PolarHBondContact O-N 3.01Å; Y1045-C1047 VanDerWaalsContact O-N 3.12Å; Y1045-Q1093 HydrophobicContact CD1-CG 4.43Å; Y1045-Q1093 VanDerWaalsContact CE1-CD 3.47Å; Y1045-Q1093 HydrophobicContact CE1-CG 3.41Å; Y1045-Q1093 VanDerWaalsContact CE1-CG 3.41Å
1046	Q	52.9	Low	68.3	Low	178 Å²	178	84.8 Å²	84.8	83%	0.832	45%	0.449	S	S	*	.			trans	-71.1	98.6	160.1	-79.7	-171.8	-16.7	0	0	108	S1048	Q1046-S1048 PolarHBondContact O-N 3Å; Q1046-S1048 VanDerWaalsContact O-N 3.08Å
1047	C	56.2	Low	68.7	Low	47 Å²	47	80.6 Å²	80.6	32%	0.318	42%	0.423	S	S	.	.			trans	-65.6	108.2	172.9	-176.6	0	0	0	0	109.2	Y1045 I1049	Y1045-C1047 PolarHBondContact O-N 3.01Å; Y1045-C1047 VanDerWaalsContact O-N 3.12Å; C1047-I1049 PolarHBondContact O-N 2.85Å
1048	S	62.6	Low	69.3	Low	87 Å²	87	79.1 Å²	79.1	61%	0.608	41%	0.412	S	S	*	.			trans	-77.5	-9	178.9	-51.8	0	0	0	0	112.6	Q1046	Q1046-S1048 PolarHBondContact O-N 3Å; Q1046-S1048 VanDerWaalsContact O-N 3.08Å
1049	I	71	Confident	70.1	Confident	18 Å²	18	78.8 Å²	78.8	9%	0.092	41%	0.414	C	S	.	.			trans	-82.2	119.7	-174.6	-56.7	172	0	0	0	110.5	C1047 V1053 F1054 Q1093 V1094	C1047-I1049 PolarHBondContact O-N 2.85Å; I1049-V1053 HydrophobicContact CG2-CB 3.6Å; I1049-V1053 HydrophobicContact CG2-CG1 3.71Å; I1049-V1053 HydrophobicContact CG2-CG2 4.19Å; I1049-F1054 HydrophobicContact CB-CE2 3.85Å; I1049-F1054 HydrophobicContact CB-CZ 4.41Å; I1049-F1054 HydrophobicContact CG2-CD2 3.89Å; I1049-F1054 HydrophobicContact CG2-CE2 3.46Å; I1049-F1054 VanDerWaalsContact CG2-CE2 3.46Å; I1049-F1054 HydrophobicContact CG2-CZ 4.14Å; I1049-Q1093 HydrophobicContact CD1-CB 3.43Å; I1049-Q1093 VanDerWaalsContact CD1-CB 3.43Å; I1049-Q1093 HydrophobicContact CG1-CB 4.26Å; I1049-V1094 HydrophobicContact CD1-CB 4.49Å; I1049-V1094 HydrophobicContact CD1-CG2 3.6Å
1050	S	77.3	Confident	71	Confident	65 Å²	65	72.8 Å²	72.8	46%	0.455	39%	0.391	S	S	.	.			trans	-63.2	147.2	174	173.2	0	0	0	0	112.3	E1052 V1053	S1050-E1052 PolarHBondContact O-N 3.34Å; S1050-E1052 VanDerWaalsContact O-N 3.1Å; S1050-E1052 PolarHBondContact OG-N 2.83Å; S1050-V1053 WeakPolarHBondContact O-CB 3.26Å; S1050-V1053 PolarHBondContact O-N 3.44Å
1051	K	81.6	Confident	72.3	Confident	103 Å²	103	68.8 Å²	68.8	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-53.6	-29	171.4	-72.4	-166.1	179	-166.4	0	112.8	V1031 D1032 V1035 V1053 F1054 K1055	V1031-K1051 HydrophobicContact CG1-CB 4.47Å; D1032-K1051 IonicContact OD1-NZ 3.16Å; D1032-K1051 PolarHBondContact OD1-NZ 3.33Å; V1035-K1051 HydrophobicContact CG2-CG 4.46Å; K1051-V1053 VanDerWaalsContact C-N 3.29Å; K1051-V1053 PolarHBondContact O-N 3.28Å; K1051-F1054 PolarHBondContact O-N 3.18Å; K1051-K1055 PolarHBondContact O-N 3.09Å
1052	E	81.6	Confident	74.1	Confident	123 Å²	123	66.3 Å²	66.3	58%	0.575	35%	0.346	S	S	*	.	H	α-helix	trans	-65.3	-31.4	178.1	-59.9	-56.2	156.8	0	0	113	S1050 S1056	S1050-E1052 PolarHBondContact O-N 3.34Å; S1050-E1052 VanDerWaalsContact O-N 3.1Å; S1050-E1052 PolarHBondContact OG-N 2.83Å; E1052-S1056 WeakPolarHBondContact O-CB 3.31Å; E1052-S1056 PolarHBondContact O-N 3.07Å; E1052-S1056 PolarHBondContact O-OG 3.37Å
1053	V	84.1	Confident	75.8	Confident	9 Å²	9	65.4 Å²	65.4	6%	0.055	34%	0.343	C	S	.	.	H	α-helix	trans	-70.1	-40.7	175.5	175.8	0	0	0	0	110.3	I1049 S1050 K1051 S1056 L1057 L1080	I1049-V1053 HydrophobicContact CG2-CB 3.6Å; I1049-V1053 HydrophobicContact CG2-CG1 3.71Å; I1049-V1053 HydrophobicContact CG2-CG2 4.19Å; S1050-V1053 WeakPolarHBondContact O-CB 3.26Å; S1050-V1053 PolarHBondContact O-N 3.44Å; K1051-V1053 VanDerWaalsContact C-N 3.29Å; K1051-V1053 PolarHBondContact O-N 3.28Å; V1053-S1056 PolarHBondContact O-N 3.14Å; V1053-L1057 VanDerWaalsContact O-CB 3.27Å; V1053-L1057 WeakPolarHBondContact O-CB 3.29Å; V1053-L1057 PolarHBondContact O-N 2.97Å; V1053-L1080 HydrophobicContact CG1-CD1 3.65Å
1054	F	86.8	Confident	77.7	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-42.3	175.3	-74	-84	0	0	0	112.3	V1031 W1034 V1035 L1038 I1049 K1051 L1057 L1058 A1097	V1031-F1054 HydrophobicContact CG1-CB 3.87Å; V1031-F1054 HydrophobicContact CG2-CB 4.22Å; W1034-F1054 AromaticContact CD2-CD1 3.68Å; W1034-F1054 HydrophobicContact CD2-CD1 3.68Å; W1034-F1054 HydrophobicContact CD2-CE1 4.05Å; W1034-F1054 AromaticContact CE3-CD1 3.75Å; W1034-F1054 HydrophobicContact CE3-CD1 3.75Å; W1034-F1054 HydrophobicContact CG-CD1 4.1Å; W1034-F1054 HydrophobicContact CG-CE1 4.18Å; W1034-F1054 HydrophobicContact CZ2-CD1 4.43Å; W1034-F1054 HydrophobicContact CZ3-CD1 4.17Å; V1035-F1054 HydrophobicContact CG2-CD2 3.93Å; V1035-F1054 HydrophobicContact CG2-CE2 3.98Å; V1035-F1054 HydrophobicContact CG2-CG 4.33Å; V1035-F1054 HydrophobicContact CG2-CZ 4.42Å; L1038-F1054 HydrophobicContact CD1-CE1 3.59Å; L1038-F1054 HydrophobicContact CD1-CZ 3.35Å; I1049-F1054 HydrophobicContact CB-CE2 3.85Å; I1049-F1054 HydrophobicContact CB-CZ 4.41Å; I1049-F1054 HydrophobicContact CG2-CD2 3.89Å; I1049-F1054 HydrophobicContact CG2-CE2 3.46Å; I1049-F1054 VanDerWaalsContact CG2-CE2 3.46Å; I1049-F1054 HydrophobicContact CG2-CZ 4.14Å; K1051-F1054 PolarHBondContact O-N 3.18Å; F1054-L1057 PolarHBondContact O-N 2.9Å; F1054-L1058 VanDerWaalsContact O-CB 3.29Å; F1054-L1058 WeakPolarHBondContact O-CB 3.18Å; F1054-L1058 PolarHBondContact O-N 3.31Å; F1054-A1097 HydrophobicContact CE1-CB 3.76Å; F1054-A1097 HydrophobicContact CZ-CB 4.25Å
1055	K	88	Confident	79.4	Confident	60 Å²	60	49.8 Å²	49.8	26%	0.261	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-45.6	174.1	-73.4	-172.4	172.5	-162.2	0	112	D1028 V1031 K1051 L1057 L1058 G1059	D1028-K1055 WeakPolarHBondContact OD1-CE 3.23Å; D1028-K1055 IonicContact OD1-NZ 3.43Å; D1028-K1055 PolarHBondContact OD1-NZ 3.26Å; V1031-K1055 HydrophobicContact CG2-CG 3.94Å; K1051-K1055 PolarHBondContact O-N 3.09Å; K1055-L1057 VanDerWaalsContact C-N 3.34Å; K1055-L1057 PolarHBondContact O-N 2.88Å; K1055-L1058 PolarHBondContact O-N 2.95Å; K1055-G1059 PolarHBondContact O-N 3.46Å
1056	S	87.5	Confident	80.8	Confident	62 Å²	62	47.1 Å²	47.1	43%	0.434	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-43.1	177	-60.3	0	0	0	0	111.7	E1052 V1053 G1059 A1060 F1076	E1052-S1056 WeakPolarHBondContact O-CB 3.31Å; E1052-S1056 PolarHBondContact O-N 3.07Å; E1052-S1056 PolarHBondContact O-OG 3.37Å; V1053-S1056 PolarHBondContact O-N 3.14Å; S1056-G1059 PolarHBondContact O-N 2.94Å; S1056-A1060 PolarHBondContact O-N 2.93Å; S1056-F1076 VanDerWaalsContact C-CZ 3.44Å; S1056-F1076 WeakPolarHBondContact O-CE2 3.5Å; S1056-F1076 WeakPolarHBondContact O-CZ 3.4Å
1057	L	88.5	Confident	82	Confident	3 Å²	3	44 Å²	44	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-45.3	177.1	-174.3	64.6	0	0	0	111.3	W1034 V1053 F1054 K1055 G1059 A1060 M1061 F1076 V1094 L1098 F1133	W1034-L1057 HydrophobicContact CH2-CD2 3.65Å; W1034-L1057 HydrophobicContact CH2-CG 4.11Å; W1034-L1057 HydrophobicContact CZ2-CD2 4.09Å; V1053-L1057 VanDerWaalsContact O-CB 3.27Å; V1053-L1057 WeakPolarHBondContact O-CB 3.29Å; V1053-L1057 PolarHBondContact O-N 2.97Å; F1054-L1057 PolarHBondContact O-N 2.9Å; K1055-L1057 VanDerWaalsContact C-N 3.34Å; K1055-L1057 PolarHBondContact O-N 2.88Å; L1057-G1059 VanDerWaalsContact C-N 3.31Å; L1057-G1059 PolarHBondContact O-N 2.78Å; L1057-A1060 PolarHBondContact O-N 3.31Å; L1057-M1061 HydrophobicContact CG-SD 4.19Å; L1057-M1061 WeakPolarHBondContact O-CB 3.48Å; L1057-M1061 WeakPolarHBondContact O-CG 3.23Å; L1057-M1061 PolarHBondContact O-N 2.82Å; L1057-F1076 HydrophobicContact CB-CE1 4.47Å; L1057-F1076 HydrophobicContact CD1-CE1 3.82Å; L1057-V1094 HydrophobicContact CD2-CG1 4.18Å; L1057-L1098 HydrophobicContact CD1-CD2 4.27Å; L1057-L1098 HydrophobicContact CD2-CD2 3.84Å; L1057-L1098 HydrophobicContact CD2-CG 4.11Å; L1057-L1098 HydrophobicContact CG-CD2 4.24Å; L1057-F1133 HydrophobicContact CD1-CD1 3.88Å; L1057-F1133 HydrophobicContact CD1-CE1 4.2Å
1058	L	89.6	Confident	83	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-41	175.9	-173.7	61.1	0	0	0	111.6	M1023 E1027 L1030 V1031 W1034 F1054 K1055 M1061 R1062 F1101	M1023-L1058 HydrophobicContact CB-CD1 4.43Å; M1023-L1058 HydrophobicContact CE-CD1 3.46Å; M1023-L1058 VanDerWaalsContact CE-CD1 3.46Å; M1023-L1058 HydrophobicContact CE-CG 4.4Å; M1023-L1058 HydrophobicContact CG-CD1 4.36Å; E1027-L1058 HydrophobicContact CB-CD2 4.4Å; E1027-L1058 HydrophobicContact CG-CD2 3.69Å; L1030-L1058 HydrophobicContact CB-CD2 4.15Å; L1030-L1058 HydrophobicContact CD1-CD2 4.29Å; V1031-L1058 HydrophobicContact CG2-CD2 4.05Å; W1034-L1058 HydrophobicContact CZ3-CB 4.33Å; F1054-L1058 VanDerWaalsContact O-CB 3.29Å; F1054-L1058 WeakPolarHBondContact O-CB 3.18Å; F1054-L1058 PolarHBondContact O-N 3.31Å; K1055-L1058 PolarHBondContact O-N 2.95Å; L1058-M1061 PolarHBondContact O-N 3.26Å; L1058-R1062 WeakPolarHBondContact O-CB 3.4Å; L1058-R1062 PolarHBondContact O-N 2.96Å; L1058-F1101 HydrophobicContact CD1-CE2 3.66Å; L1058-F1101 HydrophobicContact CD1-CZ 3.49Å; L1058-F1101 VanDerWaalsContact CD1-CZ 3.49Å
1059	G	88.2	Confident	83.6	Confident	15 Å²	15	45.9 Å²	45.9	16%	0.155	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-45	173.6	0	0	0	0	0	113.1	K1055 S1056 L1057 R1062 S1063	K1055-G1059 PolarHBondContact O-N 3.46Å; S1056-G1059 PolarHBondContact O-N 2.94Å; L1057-G1059 VanDerWaalsContact C-N 3.31Å; L1057-G1059 PolarHBondContact O-N 2.78Å; G1059-R1062 WeakPolarHBondContact O-CB 3.46Å; G1059-R1062 PolarHBondContact O-N 2.95Å; G1059-S1063 PolarHBondContact O-N 3.29Å; G1059-S1063 PolarHBondContact O-OG 3.09Å
1060	A	86.7	Confident	84	Confident	15 Å²	15	49.2 Å²	49.2	12%	0.124	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-40.3	176.3	0	0	0	0	0	112.3	S1056 L1057 R1062 S1063 Y1064 F1076 F1133	S1056-A1060 PolarHBondContact O-N 2.93Å; L1057-A1060 PolarHBondContact O-N 3.31Å; A1060-R1062 VanDerWaalsContact C-N 3.34Å; A1060-S1063 PolarHBondContact O-N 3.34Å; A1060-Y1064 WeakPolarHBondContact O-CB 3.49Å; A1060-Y1064 PolarHBondContact O-N 2.77Å; A1060-F1076 HydrophobicContact CB-CB 4.16Å; A1060-F1076 HydrophobicContact CB-CD1 3.6Å; A1060-F1076 HydrophobicContact CB-CD2 3.63Å; A1060-F1076 HydrophobicContact CB-CE1 3.82Å; A1060-F1076 HydrophobicContact CB-CE2 3.86Å; A1060-F1076 HydrophobicContact CB-CG 3.49Å; A1060-F1076 VanDerWaalsContact CB-CG 3.49Å; A1060-F1076 HydrophobicContact CB-CZ 3.95Å; A1060-F1133 HydrophobicContact CB-CE1 3.98Å; A1060-F1133 HydrophobicContact CB-CZ 3.86Å
1061	M	89.5	Confident	84	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-42.2	174	-72.2	-180	81.2	0	0	111.3	M1023 W1034 L1057 L1058 Y1064 V1065 L1098 F1101 C1129 F1133	M1023-M1061 HydrophobicContact CE-CB 3.8Å; W1034-M1061 HydrophobicContact CH2-SD 4Å; L1057-M1061 HydrophobicContact CG-SD 4.19Å; L1057-M1061 WeakPolarHBondContact O-CB 3.48Å; L1057-M1061 WeakPolarHBondContact O-CG 3.23Å; L1057-M1061 PolarHBondContact O-N 2.82Å; L1058-M1061 PolarHBondContact O-N 3.26Å; M1061-Y1064 PolarHBondContact O-N 2.92Å; M1061-V1065 VanDerWaalsContact O-CG2 3.31Å; M1061-V1065 WeakPolarHBondContact O-CG2 3.22Å; M1061-V1065 PolarHBondContact O-N 3.04Å; M1061-L1098 HydrophobicContact CE-CD2 4.06Å; M1061-L1098 HydrophobicContact SD-CD2 3.72Å; M1061-F1101 HydrophobicContact CE-CD1 3.37Å; M1061-F1101 HydrophobicContact CE-CE1 3.38Å; M1061-F1101 HydrophobicContact CE-CG 4.3Å; M1061-F1101 HydrophobicContact CE-CZ 4.34Å; M1061-F1101 HydrophobicContact SD-CD1 4.17Å; M1061-F1101 HydrophobicContact SD-CE1 4.07Å; M1061-C1129 VanDerWaalsContact CA-SG 3.56Å; M1061-C1129 WeakPolarHBondContact CB-SG 3.35Å; M1061-C1129 HydrophobicContact CE-CB 4.19Å; M1061-C1129 VanDerWaalsContact CE-SG 3.55Å; M1061-C1129 VanDerWaalsContact CG-SG 3.56Å; M1061-F1133 HydrophobicContact CB-CE2 4.31Å; M1061-F1133 HydrophobicContact CG-CD2 3.82Å; M1061-F1133 HydrophobicContact CG-CE2 3.64Å; M1061-F1133 HydrophobicContact CG-CG 4.39Å; M1061-F1133 HydrophobicContact CG-CZ 4.06Å
1062	R	87.8	Confident	83.8	Confident	56 Å²	56	46 Å²	46	21%	0.211	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-48.3	175.1	-175.1	179.5	69	-142.5	2.1	111.8	S1020 M1023 E1027 L1058 G1059 A1060 Y1064 V1065 I1066	S1020-R1062 WeakPolarHBondContact O-CD 3.28Å; S1020-R1062 WeakPolarHBondContact OG-CD 3.36Å; S1020-R1062 WeakPolarHBondContact OG-CG 3.43Å; M1023-R1062 HydrophobicContact CB-CG 4.48Å; M1023-R1062 HydrophobicContact CE-CB 4.1Å; M1023-R1062 HydrophobicContact SD-CB 4.46Å; E1027-R1062 IonicContact OE2-NH1 2.69Å; E1027-R1062 PolarHBondContact OE2-NH1 3.34Å; L1058-R1062 WeakPolarHBondContact O-CB 3.4Å; L1058-R1062 PolarHBondContact O-N 2.96Å; G1059-R1062 WeakPolarHBondContact O-CB 3.46Å; G1059-R1062 PolarHBondContact O-N 2.95Å; A1060-R1062 VanDerWaalsContact C-N 3.34Å; R1062-Y1064 VanDerWaalsContact C-N 3.32Å; R1062-Y1064 PolarHBondContact O-N 2.99Å; R1062-V1065 PolarHBondContact O-N 3.38Å; R1062-I1066 PolarHBondContact O-N 2.9Å
1063	S	85.2	Confident	83.8	Confident	47 Å²	47	40.2 Å²	40.2	33%	0.329	22%	0.215	S	C	.	.	H	α-helix	trans	-59.8	-42.8	176	-60.6	0	0	0	0	111.6	G1059 A1060 V1065 I1066 E1067	G1059-S1063 PolarHBondContact O-N 3.29Å; G1059-S1063 PolarHBondContact O-OG 3.09Å; A1060-S1063 PolarHBondContact O-N 3.34Å; S1063-V1065 PolarHBondContact O-N 3.21Å; S1063-I1066 PolarHBondContact O-N 3.12Å; S1063-E1067 WeakPolarHBondContact O-CB 3.27Å; S1063-E1067 WeakPolarHBondContact O-CG 3.31Å; S1063-E1067 PolarHBondContact O-N 3.43Å
1064	Y	86.6	Confident	83.6	Confident	24 Å²	24	46 Å²	46	9%	0.094	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-40.4	175.3	176.9	-96.6	0	0	0	113	A1060 M1061 R1062 I1066 K1068 K1070 A1073 C1129 C1132 F1133	A1060-Y1064 WeakPolarHBondContact O-CB 3.49Å; A1060-Y1064 PolarHBondContact O-N 2.77Å; M1061-Y1064 PolarHBondContact O-N 2.92Å; R1062-Y1064 VanDerWaalsContact C-N 3.32Å; R1062-Y1064 PolarHBondContact O-N 2.99Å; Y1064-I1066 VanDerWaalsContact C-N 3.28Å; Y1064-I1066 PolarHBondContact O-N 3.42Å; Y1064-K1068 WeakPolarHBondContact O-CA 3.38Å; Y1064-K1068 PolarHBondContact O-N 3.14Å; Y1064-K1070 HydrophobicContact CE2-CG 4.23Å; Y1064-A1073 HydrophobicContact CD2-CB 4.13Å; Y1064-C1129 HydrophobicContact CD1-CB 3.95Å; Y1064-C1129 HydrophobicContact CE1-CB 4.23Å; Y1064-C1132 HydrophobicContact CE1-CB 4.18Å; Y1064-C1132 HydrophobicContact CE2-CB 4.43Å; Y1064-F1133 HydrophobicContact CG-CE2 4.33Å
1065	V	84.9	Confident	83.4	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-39.3	177.8	166.3	0	0	0	0	111.2	R1016 L1019 M1023 M1061 R1062 S1063 C1129	R1016-V1065 HydrophobicContact CB-CG1 4Å; R1016-V1065 WeakPolarHBondContact CD-O 3.37Å; R1016-V1065 HydrophobicContact CG-CG1 4.11Å; R1016-V1065 VanDerWaalsContact CG-O 3.27Å; R1016-V1065 WeakPolarHBondContact CG-O 3.38Å; R1016-V1065 PolarHBondContact NH1-O 3.44Å; L1019-V1065 HydrophobicContact CB-CG1 4.21Å; L1019-V1065 HydrophobicContact CD2-CG1 4Å; L1019-V1065 HydrophobicContact CD2-CG2 4.18Å; L1019-V1065 HydrophobicContact CG-CG1 4.4Å; M1023-V1065 HydrophobicContact SD-CG2 4.45Å; M1061-V1065 VanDerWaalsContact O-CG2 3.31Å; M1061-V1065 WeakPolarHBondContact O-CG2 3.22Å; M1061-V1065 PolarHBondContact O-N 3.04Å; R1062-V1065 PolarHBondContact O-N 3.38Å; S1063-V1065 PolarHBondContact O-N 3.21Å; V1065-C1129 HydrophobicContact CG2-CB 4.12Å
1066	I	80.5	Confident	83.3	Confident	72 Å²	72	49.9 Å²	49.9	37%	0.369	26%	0.258	S	S	.	.	H	α-helix	trans	-76.8	-54.2	177.4	-66.1	167.6	0	0	0	111.5	S1020 R1062 S1063 Y1064	S1020-I1066 WeakPolarHBondContact OG-CD1 3.4Å; R1062-I1066 PolarHBondContact O-N 2.9Å; S1063-I1066 PolarHBondContact O-N 3.12Å; Y1064-I1066 VanDerWaalsContact C-N 3.28Å; Y1064-I1066 PolarHBondContact O-N 3.42Å
1067	E	78.8	Confident	83.1	Confident	113 Å²	113	47.2 Å²	47.2	53%	0.528	24%	0.239	S	C	.	.	H	α-helix	trans	-81.8	-24.8	-166.7	-64.5	176.7	174.5	0	0	113.6	S1063 D1069 S1072	S1063-E1067 WeakPolarHBondContact O-CB 3.27Å; S1063-E1067 WeakPolarHBondContact O-CG 3.31Å; S1063-E1067 PolarHBondContact O-N 3.43Å; E1067-D1069 HydrophobicContact CB-CB 4.28Å; E1067-D1069 PolarHBondContact O-N 2.88Å; E1067-D1069 VanDerWaalsContact O-N 3.07Å; E1067-S1072 PolarHBondContact OE2-OG 3.39Å
1068	K	76.2	Confident	82.8	Confident	110 Å²	110	52.4 Å²	52.4	48%	0.478	27%	0.266	S	S	.	.			trans	55.7	9.4	-167.1	-68.7	-177.4	177.8	172.3	0	115	D1012 Y1064 K1070	D1012-K1068 IonicContact OD2-NZ 2.67Å; D1012-K1068 PolarHBondContact OD2-NZ 3.35Å; Y1064-K1068 WeakPolarHBondContact O-CA 3.38Å; Y1064-K1068 PolarHBondContact O-N 3.14Å; K1068-K1070 PolarHBondContact O-N 2.8Å
1069	D	75.6	Confident	82.5	Confident	63 Å²	63	57.9 Å²	57.9	34%	0.337	29%	0.292	S	S	.	.			trans	-80.8	114.8	-176.3	-172.9	11.8	0	0	0	111.3	E1067 S1071	E1067-D1069 HydrophobicContact CB-CB 4.28Å; E1067-D1069 PolarHBondContact O-N 2.88Å; E1067-D1069 VanDerWaalsContact O-N 3.07Å; D1069-S1071 VanDerWaalsContact CG-OG 3.24Å; D1069-S1071 PolarHBondContact O-N 3.35Å; D1069-S1071 VanDerWaalsContact OD1-CB 3.24Å; D1069-S1071 WeakPolarHBondContact OD1-CB 3.28Å; D1069-S1071 PolarHBondContact OD1-N 3.09Å; D1069-S1071 PolarHBondContact OD1-OG 2.95Å; D1069-S1071 WeakPolarHBondContact OD2-CB 3.49Å; D1069-S1071 PolarHBondContact OD2-OG 3.05Å
1070	K	79.1	Confident	82.2	Confident	88 Å²	88	57.5 Å²	57.5	38%	0.383	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-19.7	172.5	-72.1	-166.6	176.2	-165.6	0	111.9	Y1064 K1068 R1074 E1135	Y1064-K1070 HydrophobicContact CE2-CG 4.23Å; K1068-K1070 PolarHBondContact O-N 2.8Å; K1070-R1074 WeakPolarHBondContact O-CB 3.35Å; K1070-R1074 WeakPolarHBondContact O-CG 3.28Å; K1070-R1074 PolarHBondContact O-N 3.41Å; K1070-E1135 IonicContact NZ-OE2 2.8Å
1071	S	76.7	Confident	81.9	Confident	53 Å²	53	58.1 Å²	58.1	37%	0.371	29%	0.286	S	S	.	.	H	α-helix	trans	-70.1	-46.8	-179.2	97.5	0	0	0	0	111.8	D1069 A1073 R1074 N1075	D1069-S1071 VanDerWaalsContact CG-OG 3.24Å; D1069-S1071 PolarHBondContact O-N 3.35Å; D1069-S1071 VanDerWaalsContact OD1-CB 3.24Å; D1069-S1071 WeakPolarHBondContact OD1-CB 3.28Å; D1069-S1071 PolarHBondContact OD1-N 3.09Å; D1069-S1071 PolarHBondContact OD1-OG 2.95Å; D1069-S1071 WeakPolarHBondContact OD2-CB 3.49Å; D1069-S1071 PolarHBondContact OD2-OG 3.05Å; S1071-A1073 VanDerWaalsContact C-N 3.33Å; S1071-A1073 PolarHBondContact O-N 3.21Å; S1071-R1074 PolarHBondContact O-N 3.41Å; S1071-N1075 PolarHBondContact O-N 3.2Å; S1071-N1075 PolarHBondContact O-ND2 3.44Å
1072	S	77	Confident	81.4	Confident	47 Å²	47	65 Å²	65	33%	0.329	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-44.8	172.3	-60.7	0	0	0	0	111.9	E1067 N1075 F1076	E1067-S1072 PolarHBondContact OE2-OG 3.39Å; S1072-N1075 PolarHBondContact O-N 3.4Å; S1072-F1076 PolarHBondContact O-N 2.71Å; S1072-F1076 VanDerWaalsContact O-N 3.07Å
1073	A	82.5	Confident	80.9	Confident	2 Å²	2	68.4 Å²	68.4	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-40.8	177.7	0	0	0	0	0	112.7	Y1064 S1071 F1076 V1077 F1133 L1136	Y1064-A1073 HydrophobicContact CD2-CB 4.13Å; S1071-A1073 VanDerWaalsContact C-N 3.33Å; S1071-A1073 PolarHBondContact O-N 3.21Å; A1073-F1076 PolarHBondContact O-N 3.36Å; A1073-V1077 WeakPolarHBondContact O-CG2 3.17Å; A1073-V1077 PolarHBondContact O-N 2.7Å; A1073-F1133 HydrophobicContact CB-CE1 4.31Å; A1073-F1133 HydrophobicContact CB-CE2 4.26Å; A1073-F1133 HydrophobicContact CB-CZ 3.91Å; A1073-L1136 HydrophobicContact CB-CD1 3.8Å
1074	R	80.8	Confident	80.6	Confident	129 Å²	129	67.4 Å²	67.4	49%	0.487	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-48.3	174.6	-83.1	175	-171.1	154.4	0.8	112.3	K1070 S1071 F1076 V1077 L1078 L1136	K1070-R1074 WeakPolarHBondContact O-CB 3.35Å; K1070-R1074 WeakPolarHBondContact O-CG 3.28Å; K1070-R1074 PolarHBondContact O-N 3.41Å; S1071-R1074 PolarHBondContact O-N 3.41Å; R1074-F1076 VanDerWaalsContact C-N 3.29Å; R1074-F1076 PolarHBondContact O-N 3.4Å; R1074-V1077 PolarHBondContact O-N 3.49Å; R1074-L1078 WeakPolarHBondContact O-CG 3.4Å; R1074-L1078 PolarHBondContact O-N 3.11Å; R1074-L1136 HydrophobicContact CG-CD1 3.94Å; R1074-L1136 HydrophobicContact CG-CD2 3.39Å; R1074-L1136 HydrophobicContact CG-CG 4.29Å
1075	N	81.5	Confident	79.9	Confident	103 Å²	103	73.3 Å²	73.3	55%	0.551	36%	0.36	S	S	*	.	H	α-helix	trans	-61.5	-40.4	179.8	-70	-23.6	0	0	0	111.4	S1071 S1072 L1078 H1079	S1071-N1075 PolarHBondContact O-N 3.2Å; S1071-N1075 PolarHBondContact O-ND2 3.44Å; S1072-N1075 PolarHBondContact O-N 3.4Å; N1075-L1078 PolarHBondContact O-N 3.37Å; N1075-H1079 PolarHBondContact O-N 3.4Å; N1075-H1079 VanDerWaalsContact O-N 3.07Å
1076	F	85.8	Confident	79.1	Confident	43 Å²	43	78 Å²	78	19%	0.189	39%	0.385	C	S	.	.	H	α-helix	trans	-62.8	-45.3	173.7	-179.9	-92.5	0	0	0	112.3	S1056 L1057 A1060 S1072 A1073 R1074 L1078 H1079 L1080 F1133	S1056-F1076 VanDerWaalsContact C-CZ 3.44Å; S1056-F1076 WeakPolarHBondContact O-CE2 3.5Å; S1056-F1076 WeakPolarHBondContact O-CZ 3.4Å; L1057-F1076 HydrophobicContact CB-CE1 4.47Å; L1057-F1076 HydrophobicContact CD1-CE1 3.82Å; A1060-F1076 HydrophobicContact CB-CB 4.16Å; A1060-F1076 HydrophobicContact CB-CD1 3.6Å; A1060-F1076 HydrophobicContact CB-CD2 3.63Å; A1060-F1076 HydrophobicContact CB-CE1 3.82Å; A1060-F1076 HydrophobicContact CB-CE2 3.86Å; A1060-F1076 HydrophobicContact CB-CG 3.49Å; A1060-F1076 VanDerWaalsContact CB-CG 3.49Å; A1060-F1076 HydrophobicContact CB-CZ 3.95Å; S1072-F1076 PolarHBondContact O-N 2.71Å; S1072-F1076 VanDerWaalsContact O-N 3.07Å; A1073-F1076 PolarHBondContact O-N 3.36Å; R1074-F1076 VanDerWaalsContact C-N 3.29Å; R1074-F1076 PolarHBondContact O-N 3.4Å; F1076-L1078 VanDerWaalsContact C-N 3.31Å; F1076-L1078 PolarHBondContact O-N 3.15Å; F1076-H1079 PolarHBondContact O-N 2.96Å; F1076-L1080 HydrophobicContact CE1-CB 4.33Å; F1076-L1080 HydrophobicContact CE1-CD2 4.16Å; F1076-L1080 WeakPolarHBondContact O-CB 3.34Å; F1076-L1080 PolarHBondContact O-N 2.94Å; F1076-F1133 AromaticContact CD1-CE1 3.88Å; F1076-F1133 HydrophobicContact CD1-CE1 3.88Å; F1076-F1133 HydrophobicContact CE1-CE1 4.45Å
1077	V	84.4	Confident	78.7	Confident	5 Å²	5	77.9 Å²	77.9	3%	0.03	39%	0.385	C	S	.	.	H	α-helix	trans	-64.1	-35.8	178.8	171	0	0	0	0	111.8	A1073 R1074 L1080 K1081 F1133 L1136 L1137	A1073-V1077 WeakPolarHBondContact O-CG2 3.17Å; A1073-V1077 PolarHBondContact O-N 2.7Å; R1074-V1077 PolarHBondContact O-N 3.49Å; V1077-L1080 PolarHBondContact O-N 2.55Å; V1077-K1081 HydrophobicContact CG1-CD 4.31Å; V1077-K1081 WeakPolarHBondContact O-CB 3.22Å; V1077-K1081 WeakPolarHBondContact O-CG 3.3Å; V1077-K1081 PolarHBondContact O-N 3.36Å; V1077-F1133 HydrophobicContact CG2-CD1 3.88Å; V1077-F1133 HydrophobicContact CG2-CE1 4.29Å; V1077-L1136 HydrophobicContact CB-CB 4.32Å; V1077-L1136 HydrophobicContact CG1-CB 4.2Å; V1077-L1136 HydrophobicContact CG2-CB 3.95Å; V1077-L1136 HydrophobicContact CG2-CD1 4.31Å; V1077-L1137 HydrophobicContact CG1-CD2 3.85Å; V1077-L1137 HydrophobicContact CG1-CG 4.15Å
1078	L	81.8	Confident	78.3	Confident	112 Å²	112	80.2 Å²	80.2	59%	0.586	40%	0.396	S	S	*	.	H	α-helix	trans	-63.1	-48.2	173	-71.4	172.2	0	0	0	111.7	R1074 N1075 F1076 L1080 K1081 E1082	R1074-L1078 WeakPolarHBondContact O-CG 3.4Å; R1074-L1078 PolarHBondContact O-N 3.11Å; N1075-L1078 PolarHBondContact O-N 3.37Å; F1076-L1078 VanDerWaalsContact C-N 3.31Å; F1076-L1078 PolarHBondContact O-N 3.15Å; L1078-L1080 VanDerWaalsContact C-N 3.32Å; L1078-L1080 PolarHBondContact O-N 3.45Å; L1078-K1081 PolarHBondContact O-N 3.45Å; L1078-E1082 PolarHBondContact O-N 2.73Å
1079	H	82.8	Confident	78	Confident	116 Å²	116	77.5 Å²	77.5	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-64.5	-35.6	176.3	-176.3	-82.1	0	0	0	112.2	N1075 F1076 E1082 H1083	N1075-H1079 PolarHBondContact O-N 3.4Å; N1075-H1079 VanDerWaalsContact O-N 3.07Å; F1076-H1079 PolarHBondContact O-N 2.96Å; H1079-E1082 PolarHBondContact O-N 3.12Å; H1079-H1083 VanDerWaalsContact O-CB 3.3Å; H1079-H1083 WeakPolarHBondContact O-CB 3.43Å; H1079-H1083 PolarHBondContact O-N 3.23Å
1080	L	82.4	Confident	77.9	Confident	6 Å²	6	74.7 Å²	74.7	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-41.8	175.1	-178.3	67.2	0	0	0	111.5	V1053 F1076 V1077 L1078 E1082 H1083 L1084 V1094	V1053-L1080 HydrophobicContact CG1-CD1 3.65Å; F1076-L1080 HydrophobicContact CE1-CB 4.33Å; F1076-L1080 HydrophobicContact CE1-CD2 4.16Å; F1076-L1080 WeakPolarHBondContact O-CB 3.34Å; F1076-L1080 PolarHBondContact O-N 2.94Å; V1077-L1080 PolarHBondContact O-N 2.55Å; L1078-L1080 VanDerWaalsContact C-N 3.32Å; L1078-L1080 PolarHBondContact O-N 3.45Å; L1080-E1082 VanDerWaalsContact C-N 3.33Å; L1080-H1083 PolarHBondContact O-N 3.31Å; L1080-L1084 HydrophobicContact CD1-CD1 4Å; L1080-L1084 HydrophobicContact CD1-CG 4.26Å; L1080-L1084 HydrophobicContact CG-CD1 3.98Å; L1080-L1084 WeakPolarHBondContact O-CB 3.3Å; L1080-L1084 VanDerWaalsContact O-CG 3.32Å; L1080-L1084 WeakPolarHBondContact O-CG 3.14Å; L1080-L1084 PolarHBondContact O-N 2.85Å; L1080-V1094 HydrophobicContact CD2-CG1 4.17Å
1081	K	79.8	Confident	77.7	Confident	28 Å²	28	71.7 Å²	71.7	12%	0.122	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-41	174.9	-79.4	178.1	175	-177.2	0	111.8	V1077 L1078 D1085 N1086 L1091 L1136 L1137	V1077-K1081 HydrophobicContact CG1-CD 4.31Å; V1077-K1081 WeakPolarHBondContact O-CB 3.22Å; V1077-K1081 WeakPolarHBondContact O-CG 3.3Å; V1077-K1081 PolarHBondContact O-N 3.36Å; L1078-K1081 PolarHBondContact O-N 3.45Å; K1081-D1085 PolarHBondContact O-N 3.05Å; K1081-N1086 PolarHBondContact O-N 3.24Å; K1081-L1091 HydrophobicContact CG-CD1 4.29Å; K1081-L1091 HydrophobicContact CG-CD2 3.77Å; K1081-L1136 PolarHBondContact NZ-O 2.91Å; K1081-L1137 PolarHBondContact NZ-O 3.4Å; K1081-L1137 VanDerWaalsContact NZ-O 3.1Å
1082	E	78.2	Confident	77.5	Confident	146 Å²	146	71.9 Å²	71.9	68%	0.682	37%	0.366	S	S	*	.	H	α-helix	trans	-65.9	-44.6	174.2	-169.3	175.7	-168.7	0	0	112	L1078 H1079 L1080 L1084 D1085	L1078-E1082 PolarHBondContact O-N 2.73Å; H1079-E1082 PolarHBondContact O-N 3.12Å; L1080-E1082 VanDerWaalsContact C-N 3.33Å; E1082-L1084 VanDerWaalsContact C-N 3.28Å; E1082-L1084 PolarHBondContact O-N 3.11Å; E1082-D1085 PolarHBondContact O-N 3.41Å; E1082-D1085 VanDerWaalsContact O-N 3.15Å
1083	H	79	Confident	77.4	Confident	127 Å²	127	70.4 Å²	70.4	59%	0.588	35%	0.354	S	S	*	.	H	α-helix	trans	-66.5	-27.1	179.1	-170.7	71.5	0	0	0	113.9	H1079 L1080 D1085	H1079-H1083 VanDerWaalsContact O-CB 3.3Å; H1079-H1083 WeakPolarHBondContact O-CB 3.43Å; H1079-H1083 PolarHBondContact O-N 3.23Å; L1080-H1083 PolarHBondContact O-N 3.31Å; H1083-D1085 VanDerWaalsContact C-N 3.33Å
1084	L	79	Confident	77.3	Confident	25 Å²	25	70.5 Å²	70.5	13%	0.131	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	14.1	175.9	-65.5	174.8	0	0	0	112.9	L1080 E1082 N1086 D1087 A1090 L1091 V1094	L1080-L1084 HydrophobicContact CD1-CD1 4Å; L1080-L1084 HydrophobicContact CD1-CG 4.26Å; L1080-L1084 HydrophobicContact CG-CD1 3.98Å; L1080-L1084 WeakPolarHBondContact O-CB 3.3Å; L1080-L1084 VanDerWaalsContact O-CG 3.32Å; L1080-L1084 WeakPolarHBondContact O-CG 3.14Å; L1080-L1084 PolarHBondContact O-N 2.85Å; E1082-L1084 VanDerWaalsContact C-N 3.28Å; E1082-L1084 PolarHBondContact O-N 3.11Å; L1084-N1086 PolarHBondContact O-N 3.43Å; L1084-D1087 WeakPolarHBondContact O-CB 3.43Å; L1084-D1087 PolarHBondContact O-N 2.92Å; L1084-A1090 HydrophobicContact CD1-CB 4.37Å; L1084-A1090 HydrophobicContact CD2-CB 4.3Å; L1084-L1091 HydrophobicContact CD1-CD2 4.07Å; L1084-V1094 HydrophobicContact CD1-CG2 4Å
1085	D	71.8	Confident	77.2	Confident	149 Å²	149	66 Å²	66	80%	0.797	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	26.8	-178.6	-71.7	-28.7	0	0	0	114.4	K1081 E1082 H1083 D1087	K1081-D1085 PolarHBondContact O-N 3.05Å; E1082-D1085 PolarHBondContact O-N 3.41Å; E1082-D1085 VanDerWaalsContact O-N 3.15Å; H1083-D1085 VanDerWaalsContact C-N 3.33Å; D1085-D1087 PolarHBondContact O-N 3.42Å
1086	N	67.1	Low	77	Confident	102 Å²	102	65.1 Å²	65.1	55%	0.545	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.5	-170.5	-68.5	-52.8	0	0	0	115	K1081 L1084 E1088	K1081-N1086 PolarHBondContact O-N 3.24Å; L1084-N1086 PolarHBondContact O-N 3.43Å; N1086-E1088 PolarHBondContact O-N 3.27Å; N1086-E1088 VanDerWaalsContact O-N 3.08Å
1087	D	72.1	Confident	76.9	Confident	69 Å²	69	63.1 Å²	63.1	37%	0.369	33%	0.325	S	S	.	.			trans	-63.9	109.1	173	179.8	-3.7	0	0	0	110.5	L1084 D1085 S1089 A1090 L1091	L1084-D1087 WeakPolarHBondContact O-CB 3.43Å; L1084-D1087 PolarHBondContact O-N 2.92Å; D1085-D1087 PolarHBondContact O-N 3.42Å; D1087-S1089 VanDerWaalsContact CG-OG 3.29Å; D1087-S1089 PolarHBondContact O-N 2.97Å; D1087-S1089 WeakPolarHBondContact OD1-CA 3.43Å; D1087-S1089 VanDerWaalsContact OD1-CB 3.25Å; D1087-S1089 WeakPolarHBondContact OD1-CB 3.28Å; D1087-S1089 PolarHBondContact OD1-N 2.86Å; D1087-S1089 PolarHBondContact OD1-OG 2.96Å; D1087-S1089 PolarHBondContact OD2-OG 3.36Å; D1087-S1089 VanDerWaalsContact OD2-OG 3.11Å; D1087-A1090 HydrophobicContact CB-CB 3.89Å; D1087-A1090 PolarHBondContact O-N 3.03Å; D1087-A1090 VanDerWaalsContact O-N 3.14Å; D1087-A1090 PolarHBondContact OD1-N 3.41Å; D1087-L1091 WeakPolarHBondContact O-CG 3.43Å; D1087-L1091 PolarHBondContact O-N 3.32Å
1088	E	70.3	Confident	76.9	Confident	161 Å²	161	62.9 Å²	62.9	75%	0.752	32%	0.323	S	S	*	.	H	α-helix	trans	-57.9	-30.3	178.5	-71.6	-170	160.3	0	0	112.6	N1086 S1092	N1086-E1088 PolarHBondContact O-N 3.27Å; N1086-E1088 VanDerWaalsContact O-N 3.08Å; E1088-S1092 VanDerWaalsContact O-CB 3.31Å; E1088-S1092 WeakPolarHBondContact O-CB 3.27Å; E1088-S1092 PolarHBondContact O-N 3.15Å; E1088-S1092 PolarHBondContact O-OG 2.8Å
1089	S	70.9	Confident	76.8	Confident	53 Å²	53	64.2 Å²	64.2	37%	0.371	33%	0.325	S	S	.	.	H	α-helix	trans	-71	-44.3	177.2	85.5	0	0	0	0	110.9	D1087 S1092 Q1093	D1087-S1089 VanDerWaalsContact CG-OG 3.29Å; D1087-S1089 PolarHBondContact O-N 2.97Å; D1087-S1089 WeakPolarHBondContact OD1-CA 3.43Å; D1087-S1089 VanDerWaalsContact OD1-CB 3.25Å; D1087-S1089 WeakPolarHBondContact OD1-CB 3.28Å; D1087-S1089 PolarHBondContact OD1-N 2.86Å; D1087-S1089 PolarHBondContact OD1-OG 2.96Å; D1087-S1089 PolarHBondContact OD2-OG 3.36Å; D1087-S1089 VanDerWaalsContact OD2-OG 3.11Å; S1089-S1092 PolarHBondContact O-N 3.28Å; S1089-Q1093 VanDerWaalsContact O-CG 3.26Å; S1089-Q1093 WeakPolarHBondContact O-CG 3.37Å; S1089-Q1093 PolarHBondContact O-N 3.07Å
1090	A	73	Confident	76.7	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-40.5	176.4	0	0	0	0	0	111.3	L1084 D1087 Q1093 V1094	L1084-A1090 HydrophobicContact CD1-CB 4.37Å; L1084-A1090 HydrophobicContact CD2-CB 4.3Å; D1087-A1090 HydrophobicContact CB-CB 3.89Å; D1087-A1090 PolarHBondContact O-N 3.03Å; D1087-A1090 VanDerWaalsContact O-N 3.14Å; D1087-A1090 PolarHBondContact OD1-N 3.41Å; A1090-Q1093 WeakPolarHBondContact O-CB 3.44Å; A1090-Q1093 PolarHBondContact O-N 3.11Å; A1090-V1094 WeakPolarHBondContact O-CG2 3.44Å; A1090-V1094 PolarHBondContact O-N 3.45Å
1091	L	75.9	Confident	76.9	Confident	24 Å²	24	58.9 Å²	58.9	13%	0.126	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-39.7	175.8	-69.8	171.6	0	0	0	112.3	K1081 L1084 D1087 Q1093 V1094 C1095 L1137	K1081-L1091 HydrophobicContact CG-CD1 4.29Å; K1081-L1091 HydrophobicContact CG-CD2 3.77Å; L1084-L1091 HydrophobicContact CD1-CD2 4.07Å; D1087-L1091 WeakPolarHBondContact O-CG 3.43Å; D1087-L1091 PolarHBondContact O-N 3.32Å; L1091-Q1093 VanDerWaalsContact C-N 3.34Å; L1091-V1094 PolarHBondContact O-N 2.93Å; L1091-C1095 PolarHBondContact O-N 3.36Å; L1091-C1095 PolarHBondContact O-SG 3.27Å; L1091-L1137 HydrophobicContact CD2-CD2 3.85Å
1092	S	70.6	Confident	77	Confident	58 Å²	58	60 Å²	60	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-39	174.3	-62.7	0	0	0	0	111.8	E1088 S1089 C1095 F1096	E1088-S1092 VanDerWaalsContact O-CB 3.31Å; E1088-S1092 WeakPolarHBondContact O-CB 3.27Å; E1088-S1092 PolarHBondContact O-N 3.15Å; E1088-S1092 PolarHBondContact O-OG 2.8Å; S1089-S1092 PolarHBondContact O-N 3.28Å; S1092-C1095 WeakPolarHBondContact O-CB 3.23Å; S1092-C1095 PolarHBondContact O-N 3.41Å; S1092-F1096 PolarHBondContact O-N 3.09Å
1093	Q	74.8	Confident	77	Confident	16 Å²	16	58.2 Å²	58.2	8%	0.075	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-41.7	172.9	-72.8	171.1	44	0	0	112.1	Y1045 I1049 S1089 A1090 L1091 F1096 A1097	Y1045-Q1093 HydrophobicContact CD1-CG 4.43Å; Y1045-Q1093 VanDerWaalsContact CE1-CD 3.47Å; Y1045-Q1093 HydrophobicContact CE1-CG 3.41Å; Y1045-Q1093 VanDerWaalsContact CE1-CG 3.41Å; I1049-Q1093 HydrophobicContact CD1-CB 3.43Å; I1049-Q1093 VanDerWaalsContact CD1-CB 3.43Å; I1049-Q1093 HydrophobicContact CG1-CB 4.26Å; S1089-Q1093 VanDerWaalsContact O-CG 3.26Å; S1089-Q1093 WeakPolarHBondContact O-CG 3.37Å; S1089-Q1093 PolarHBondContact O-N 3.07Å; A1090-Q1093 WeakPolarHBondContact O-CB 3.44Å; A1090-Q1093 PolarHBondContact O-N 3.11Å; L1091-Q1093 VanDerWaalsContact C-N 3.34Å; Q1093-F1096 PolarHBondContact O-N 2.95Å; Q1093-A1097 WeakPolarHBondContact O-CB 3.32Å; Q1093-A1097 PolarHBondContact O-N 3.14Å
1094	V	80.6	Confident	77.2	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-41.6	174.5	175.2	0	0	0	0	111.2	I1049 L1057 L1080 L1084 A1090 L1091 F1096 A1097 L1098 L1137	I1049-V1094 HydrophobicContact CD1-CB 4.49Å; I1049-V1094 HydrophobicContact CD1-CG2 3.6Å; L1057-V1094 HydrophobicContact CD2-CG1 4.18Å; L1080-V1094 HydrophobicContact CD2-CG1 4.17Å; L1084-V1094 HydrophobicContact CD1-CG2 4Å; A1090-V1094 WeakPolarHBondContact O-CG2 3.44Å; A1090-V1094 PolarHBondContact O-N 3.45Å; L1091-V1094 PolarHBondContact O-N 2.93Å; V1094-F1096 PolarHBondContact O-N 3.05Å; V1094-A1097 WeakPolarHBondContact O-CB 3.42Å; V1094-A1097 PolarHBondContact O-N 2.95Å; V1094-L1098 HydrophobicContact CG1-CD1 4.2Å; V1094-L1098 WeakPolarHBondContact O-CG 3.4Å; V1094-L1098 PolarHBondContact O-N 3.1Å; V1094-L1137 HydrophobicContact CB-CD1 4.47Å; V1094-L1137 HydrophobicContact CG1-CD1 3.68Å
1095	C	79.9	Confident	77.5	Confident	34 Å²	34	51.1 Å²	51.1	23%	0.23	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-43.3	175.5	-75.3	0	0	0	0	112.2	L1091 S1092 L1098 F1099	L1091-C1095 PolarHBondContact O-N 3.36Å; L1091-C1095 PolarHBondContact O-SG 3.27Å; S1092-C1095 WeakPolarHBondContact O-CB 3.23Å; S1092-C1095 PolarHBondContact O-N 3.41Å; C1095-L1098 PolarHBondContact O-N 3.44Å; C1095-F1099 PolarHBondContact O-N 3.16Å
1096	F	78	Confident	77.8	Confident	86 Å²	86	44.9 Å²	44.9	38%	0.377	23%	0.234	S	C	.	.	H	α-helix	trans	-67.1	-41.3	175.9	-175	-111.2	0	0	0	111.8	L1038 S1092 Q1093 V1094 L1098 F1099 V1100	L1038-F1096 HydrophobicContact CD2-CD1 3.43Å; L1038-F1096 VanDerWaalsContact CD2-CD1 3.43Å; L1038-F1096 HydrophobicContact CD2-CE1 3.8Å; S1092-F1096 PolarHBondContact O-N 3.09Å; Q1093-F1096 PolarHBondContact O-N 2.95Å; V1094-F1096 PolarHBondContact O-N 3.05Å; F1096-L1098 VanDerWaalsContact C-N 3.34Å; F1096-L1098 PolarHBondContact O-N 3.31Å; F1096-F1099 VanDerWaalsContact O-CB 3.31Å; F1096-F1099 WeakPolarHBondContact O-CB 3.33Å; F1096-F1099 PolarHBondContact O-N 3.36Å; F1096-V1100 HydrophobicContact CD1-CG2 4.39Å; F1096-V1100 HydrophobicContact CE1-CG2 3.97Å; F1096-V1100 HydrophobicContact CE2-CG2 4.42Å; F1096-V1100 HydrophobicContact CZ-CG2 3.99Å; F1096-V1100 PolarHBondContact O-N 3.47Å; F1096-V1100 VanDerWaalsContact O-N 3.11Å
1097	A	81.7	Confident	78.4	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-55.5	-47.7	172.6	0	0	0	0	0	112	W1034 L1038 F1054 Q1093 V1094 F1099 V1100 F1101	W1034-A1097 HydrophobicContact CZ2-CB 4.4Å; W1034-A1097 PolarHBondContact NE1-O 3.26Å; L1038-A1097 HydrophobicContact CD1-CB 3.81Å; L1038-A1097 HydrophobicContact CD2-CB 4.24Å; F1054-A1097 HydrophobicContact CE1-CB 3.76Å; F1054-A1097 HydrophobicContact CZ-CB 4.25Å; Q1093-A1097 WeakPolarHBondContact O-CB 3.32Å; Q1093-A1097 PolarHBondContact O-N 3.14Å; V1094-A1097 WeakPolarHBondContact O-CB 3.42Å; V1094-A1097 PolarHBondContact O-N 2.95Å; A1097-F1099 PolarHBondContact O-N 3.03Å; A1097-V1100 PolarHBondContact O-N 3.01Å; A1097-V1100 VanDerWaalsContact O-N 3.12Å; A1097-F1101 PolarHBondContact O-N 3.37Å
1098	L	84.9	Confident	78.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-29.8	176.7	-75.5	165.8	0	0	0	113.1	L1057 M1061 V1094 C1095 F1096 F1133 I1134 L1137	L1057-L1098 HydrophobicContact CD1-CD2 4.27Å; L1057-L1098 HydrophobicContact CD2-CD2 3.84Å; L1057-L1098 HydrophobicContact CD2-CG 4.11Å; L1057-L1098 HydrophobicContact CG-CD2 4.24Å; M1061-L1098 HydrophobicContact CE-CD2 4.06Å; M1061-L1098 HydrophobicContact SD-CD2 3.72Å; V1094-L1098 HydrophobicContact CG1-CD1 4.2Å; V1094-L1098 WeakPolarHBondContact O-CG 3.4Å; V1094-L1098 PolarHBondContact O-N 3.1Å; C1095-L1098 PolarHBondContact O-N 3.44Å; F1096-L1098 VanDerWaalsContact C-N 3.34Å; F1096-L1098 PolarHBondContact O-N 3.31Å; L1098-F1133 HydrophobicContact CD1-CB 3.61Å; L1098-F1133 HydrophobicContact CD2-CB 3.91Å; L1098-F1133 HydrophobicContact CG-CB 4.43Å; L1098-I1134 HydrophobicContact CB-CD1 3.96Å; L1098-I1134 HydrophobicContact CB-CG1 3.65Å; L1098-I1134 HydrophobicContact CD1-CG1 3.95Å; L1098-I1134 HydrophobicContact CG-CG1 4.45Å; L1098-L1137 HydrophobicContact CD1-CD1 3.44Å; L1098-L1137 VanDerWaalsContact CD1-CD1 3.44Å
1099	F	79.4	Confident	79.4	Confident	139 Å²	139	35 Å²	35	61%	0.61	18%	0.178	S	C	*	.	H	α-helix	trans	-69.3	-46.2	174	-170.4	-92.8	0	0	0	111.7	C1095 F1096 A1097 F1101	C1095-F1099 PolarHBondContact O-N 3.16Å; F1096-F1099 VanDerWaalsContact O-CB 3.31Å; F1096-F1099 WeakPolarHBondContact O-CB 3.33Å; F1096-F1099 PolarHBondContact O-N 3.36Å; A1097-F1099 PolarHBondContact O-N 3.03Å; F1099-F1101 VanDerWaalsContact C-N 3.28Å; F1099-F1101 PolarHBondContact O-N 3.31Å
1100	V	82.2	Confident	79.5	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	19%	0.187	C	C	.	.	H	α-helix	trans	-70	-23.8	-180	179.3	0	0	0	0	112.6	S1037 F1096 A1097 Q1102 D1103 V1104	S1037-V1100 VanDerWaalsContact CB-CG1 3.46Å; F1096-V1100 HydrophobicContact CD1-CG2 4.39Å; F1096-V1100 HydrophobicContact CE1-CG2 3.97Å; F1096-V1100 HydrophobicContact CE2-CG2 4.42Å; F1096-V1100 HydrophobicContact CZ-CG2 3.99Å; F1096-V1100 PolarHBondContact O-N 3.47Å; F1096-V1100 VanDerWaalsContact O-N 3.11Å; A1097-V1100 PolarHBondContact O-N 3.01Å; A1097-V1100 VanDerWaalsContact O-N 3.12Å; V1100-Q1102 PolarHBondContact O-N 3.34Å; V1100-Q1102 VanDerWaalsContact O-N 3.15Å; V1100-D1103 PolarHBondContact O-N 3.14Å; V1100-D1103 VanDerWaalsContact O-N 3.11Å; V1100-V1104 HydrophobicContact CG1-CG2 4.36Å; V1100-V1104 PolarHBondContact O-N 3.47Å
1101	F	86.7	Confident	79.7	Confident	1 Å²	1	45 Å²	45	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-55.5	-34.6	-179	-175.8	-116.5	0	0	0	113.7	M1023 W1034 L1058 M1061 A1097 F1099 D1103 V1104 M1105 T1126	M1023-F1101 HydrophobicContact CE-CZ 4.15Å; W1034-F1101 HydrophobicContact CD2-CB 4.44Å; W1034-F1101 AromaticContact CD2-CD2 3.58Å; W1034-F1101 HydrophobicContact CD2-CD2 3.58Å; W1034-F1101 HydrophobicContact CD2-CE2 4.33Å; W1034-F1101 HydrophobicContact CD2-CG 4.42Å; W1034-F1101 AromaticContact CE2-CD2 3.56Å; W1034-F1101 AromaticContact CE2-CG 3.94Å; W1034-F1101 AromaticContact CE3-CD2 3.55Å; W1034-F1101 HydrophobicContact CE3-CD2 3.55Å; W1034-F1101 AromaticContact CE3-CE2 3.87Å; W1034-F1101 HydrophobicContact CE3-CE2 3.87Å; W1034-F1101 HydrophobicContact CG-CD2 4.35Å; W1034-F1101 HydrophobicContact CH2-CB 4.18Å; W1034-F1101 AromaticContact CH2-CD2 3.55Å; W1034-F1101 HydrophobicContact CH2-CD2 3.55Å; W1034-F1101 HydrophobicContact CH2-CE2 4.07Å; W1034-F1101 AromaticContact CH2-CG 3.87Å; W1034-F1101 HydrophobicContact CH2-CG 3.87Å; W1034-F1101 HydrophobicContact CZ2-CB 3.48Å; W1034-F1101 VanDerWaalsContact CZ2-CB 3.48Å; W1034-F1101 AromaticContact CZ2-CD2 3.59Å; W1034-F1101 HydrophobicContact CZ2-CD2 3.59Å; W1034-F1101 AromaticContact CZ2-CG 3.69Å; W1034-F1101 HydrophobicContact CZ2-CG 3.69Å; W1034-F1101 AromaticContact CZ3-CD2 3.53Å; W1034-F1101 HydrophobicContact CZ3-CD2 3.53Å; W1034-F1101 AromaticContact CZ3-CE2 3.72Å; W1034-F1101 HydrophobicContact CZ3-CE2 3.72Å; W1034-F1101 HydrophobicContact CZ3-CG 4.32Å; L1058-F1101 HydrophobicContact CD1-CE2 3.66Å; L1058-F1101 HydrophobicContact CD1-CZ 3.49Å; L1058-F1101 VanDerWaalsContact CD1-CZ 3.49Å; M1061-F1101 HydrophobicContact CE-CD1 3.37Å; M1061-F1101 HydrophobicContact CE-CE1 3.38Å; M1061-F1101 HydrophobicContact CE-CG 4.3Å; M1061-F1101 HydrophobicContact CE-CZ 4.34Å; M1061-F1101 HydrophobicContact SD-CD1 4.17Å; M1061-F1101 HydrophobicContact SD-CE1 4.07Å; A1097-F1101 PolarHBondContact O-N 3.37Å; F1099-F1101 VanDerWaalsContact C-N 3.28Å; F1099-F1101 PolarHBondContact O-N 3.31Å; F1101-D1103 VanDerWaalsContact C-N 3.28Å; F1101-D1103 PolarHBondContact O-N 2.69Å; F1101-V1104 PolarHBondContact O-N 3.27Å; F1101-M1105 HydrophobicContact CD1-CG 3.96Å; F1101-M1105 HydrophobicContact CD2-CG 4.14Å; F1101-M1105 HydrophobicContact CE1-CG 3.39Å; F1101-M1105 HydrophobicContact CE1-SD 4.24Å; F1101-M1105 HydrophobicContact CE2-CG 3.57Å; F1101-M1105 HydrophobicContact CE2-SD 3.94Å; F1101-M1105 HydrophobicContact CG-CG 4.33Å; F1101-M1105 HydrophobicContact CZ-CG 3.18Å; F1101-M1105 HydrophobicContact CZ-SD 3.52Å; F1101-M1105 VanDerWaalsContact CZ-SD 3.52Å; F1101-M1105 PolarHBondContact O-N 3.07Å; F1101-T1126 HydrophobicContact CD1-CG2 3.93Å; F1101-T1126 HydrophobicContact CE1-CG2 3.81Å
1102	Q	80.7	Confident	79.7	Confident	52 Å²	52	46.4 Å²	46.4	24%	0.243	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-43.5	-180	-176.4	174.6	-1.5	0	0	111.1	V1100 H1106 D1123	V1100-Q1102 PolarHBondContact O-N 3.34Å; V1100-Q1102 VanDerWaalsContact O-N 3.15Å; Q1102-H1106 VanDerWaalsContact O-CB 3.28Å; Q1102-H1106 WeakPolarHBondContact O-CB 3.33Å; Q1102-H1106 PolarHBondContact O-N 3.02Å; Q1102-D1123 PolarHBondContact NE2-OD1 3.11Å
1103	D	78.2	Confident	79.6	Confident	108 Å²	108	54 Å²	54	58%	0.578	24%	0.243	S	C	*	.	H	α-helix	trans	-69.9	-38.9	-178.8	-66.3	-35.7	0	0	0	111.8	V1100 F1101 H1106 Y1107	V1100-D1103 PolarHBondContact O-N 3.14Å; V1100-D1103 VanDerWaalsContact O-N 3.11Å; F1101-D1103 VanDerWaalsContact C-N 3.28Å; F1101-D1103 PolarHBondContact O-N 2.69Å; D1103-H1106 PolarHBondContact O-N 3.35Å; D1103-Y1107 PolarHBondContact O-N 3.36Å
1104	V	84.4	Confident	79.4	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-49.8	175.7	174.7	0	0	0	0	110.8	L1030 L1033 W1034 V1100 F1101 H1106 Y1107 V1108	L1030-V1104 HydrophobicContact CD2-CG1 3.88Å; L1033-V1104 HydrophobicContact CB-CG1 3.68Å; W1034-V1104 HydrophobicContact CB-CG1 4.29Å; W1034-V1104 HydrophobicContact CB-CG2 4.24Å; W1034-V1104 HydrophobicContact CG-CG2 4.42Å; V1100-V1104 HydrophobicContact CG1-CG2 4.36Å; V1100-V1104 PolarHBondContact O-N 3.47Å; F1101-V1104 PolarHBondContact O-N 3.27Å; V1104-H1106 VanDerWaalsContact C-N 3.34Å; V1104-H1106 PolarHBondContact O-N 2.96Å; V1104-Y1107 PolarHBondContact O-N 2.76Å; V1104-V1108 PolarHBondContact O-N 3.44Å; V1104-V1108 VanDerWaalsContact O-N 3.16Å
1105	M	85.2	Confident	78.6	Confident	0 Å²	0	60 Å²	60	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-43	175.3	-79	-60.9	-60.5	0	0	111.6	L1019 M1023 L1030 F1101 Y1107 V1108 L1109 T1126	L1019-M1105 HydrophobicContact CD1-CE 3.42Å; L1019-M1105 VanDerWaalsContact CD1-CE 3.42Å; L1019-M1105 HydrophobicContact CG-CE 4.44Å; M1023-M1105 HydrophobicContact CG-CE 3.78Å; M1023-M1105 HydrophobicContact CG-SD 4.12Å; L1030-M1105 HydrophobicContact CD1-SD 3.68Å; L1030-M1105 HydrophobicContact CD2-CG 4.4Å; L1030-M1105 HydrophobicContact CD2-SD 3.41Å; L1030-M1105 WeakPolarHBondContact CD2-SD 3.43Å; L1030-M1105 HydrophobicContact CG-SD 4.21Å; F1101-M1105 HydrophobicContact CD1-CG 3.96Å; F1101-M1105 HydrophobicContact CD2-CG 4.14Å; F1101-M1105 HydrophobicContact CE1-CG 3.39Å; F1101-M1105 HydrophobicContact CE1-SD 4.24Å; F1101-M1105 HydrophobicContact CE2-CG 3.57Å; F1101-M1105 HydrophobicContact CE2-SD 3.94Å; F1101-M1105 HydrophobicContact CG-CG 4.33Å; F1101-M1105 HydrophobicContact CZ-CG 3.18Å; F1101-M1105 HydrophobicContact CZ-SD 3.52Å; F1101-M1105 VanDerWaalsContact CZ-SD 3.52Å; F1101-M1105 PolarHBondContact O-N 3.07Å; M1105-Y1107 VanDerWaalsContact C-N 3.29Å; M1105-Y1107 PolarHBondContact O-N 3.23Å; M1105-V1108 PolarHBondContact O-N 3Å; M1105-L1109 HydrophobicContact CE-CG 4.4Å; M1105-L1109 WeakPolarHBondContact O-CB 3.32Å; M1105-L1109 WeakPolarHBondContact O-CG 3.45Å; M1105-L1109 PolarHBondContact O-N 3.48Å; M1105-T1126 HydrophobicContact CB-CG2 3.7Å; M1105-T1126 HydrophobicContact CG-CG2 3.69Å
1106	H	78.5	Confident	77.6	Confident	18 Å²	18	59.7 Å²	59.7	8%	0.083	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-38.2	-180	-156.2	113.8	0	0	0	111.7	Q1102 D1103 V1104 R1110 D1123	Q1102-H1106 VanDerWaalsContact O-CB 3.28Å; Q1102-H1106 WeakPolarHBondContact O-CB 3.33Å; Q1102-H1106 PolarHBondContact O-N 3.02Å; D1103-H1106 PolarHBondContact O-N 3.35Å; V1104-H1106 VanDerWaalsContact C-N 3.34Å; V1104-H1106 PolarHBondContact O-N 2.96Å; H1106-R1110 PolarHBondContact CD2-NE 3.47Å; H1106-R1110 PolarHBondContact CD2-NH2 3.27Å; H1106-R1110 PolarHBondContact NE2-NE 3Å; H1106-R1110 PolarHBondContact NE2-NH2 3Å; H1106-R1110 WeakPolarHBondContact O-CG 3.25Å; H1106-R1110 PolarHBondContact O-N 3.29Å; H1106-R1110 VanDerWaalsContact O-N 3.17Å; H1106-D1123 IonicContact CE1-OD2 3.48Å; H1106-D1123 PolarHBondContact CE1-OD2 3.45Å; H1106-D1123 IonicContact ND1-OD1 2.65Å; H1106-D1123 PolarHBondContact ND1-OD1 3.3Å; H1106-D1123 IonicContact ND1-OD2 3.33Å; H1106-D1123 PolarHBondContact ND1-OD2 3.3Å
1107	Y	79.5	Confident	76.8	Confident	121 Å²	121	57.3 Å²	57.3	48%	0.475	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-49.1	174	177.8	-96.3	0	0	0	112	L1033 D1103 V1104 M1105 R1110 Q1111	L1033-Y1107 HydrophobicContact CD1-CD1 3.85Å; L1033-Y1107 HydrophobicContact CD1-CE1 4.07Å; L1033-Y1107 HydrophobicContact CD2-CD1 4.14Å; L1033-Y1107 HydrophobicContact CD2-CE1 4.09Å; D1103-Y1107 PolarHBondContact O-N 3.36Å; V1104-Y1107 PolarHBondContact O-N 2.76Å; M1105-Y1107 VanDerWaalsContact C-N 3.29Å; M1105-Y1107 PolarHBondContact O-N 3.23Å; Y1107-R1110 PolarHBondContact O-N 2.98Å; Y1107-Q1111 WeakPolarHBondContact O-CG 3.43Å; Y1107-Q1111 PolarHBondContact O-N 2.82Å; Y1107-Q1111 PolarHBondContact OH-NE2 3.37Å
1108	V	81.9	Confident	76.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-65.5	-44.4	179	174.9	0	0	0	0	111.2	I1022 F1026 L1030 L1033 V1104 M1105 R1110 Q1111 Q1112	I1022-V1108 HydrophobicContact CG2-CG1 4.16Å; F1026-V1108 HydrophobicContact CB-CG1 4.18Å; F1026-V1108 HydrophobicContact CD2-CG1 4.44Å; F1026-V1108 HydrophobicContact CG-CG1 4.18Å; L1030-V1108 HydrophobicContact CD2-CB 3.93Å; L1030-V1108 HydrophobicContact CD2-CG1 4.34Å; L1030-V1108 HydrophobicContact CD2-CG2 3.5Å; L1030-V1108 HydrophobicContact CG-CG2 4.23Å; L1033-V1108 HydrophobicContact CD1-CG2 3.74Å; V1104-V1108 PolarHBondContact O-N 3.44Å; V1104-V1108 VanDerWaalsContact O-N 3.16Å; M1105-V1108 PolarHBondContact O-N 3Å; V1108-R1110 PolarHBondContact O-N 3.38Å; V1108-Q1111 WeakPolarHBondContact O-CB 3.38Å; V1108-Q1111 PolarHBondContact O-N 2.64Å; V1108-Q1112 WeakPolarHBondContact O-CG 3.31Å; V1108-Q1112 PolarHBondContact O-N 2.87Å
1109	L	80.4	Confident	75.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-58.3	-35.2	178.2	-70.6	173.1	0	0	0	112.3	L1019 I1022 M1105 Q1111 Q1112 I1114 M1119 L1122	L1019-L1109 HydrophobicContact CD1-CD1 4.42Å; L1019-L1109 HydrophobicContact CD1-CD2 4.07Å; I1022-L1109 HydrophobicContact CD1-CD2 3.76Å; I1022-L1109 HydrophobicContact CG2-CD2 4.33Å; M1105-L1109 HydrophobicContact CE-CG 4.4Å; M1105-L1109 WeakPolarHBondContact O-CB 3.32Å; M1105-L1109 WeakPolarHBondContact O-CG 3.45Å; M1105-L1109 PolarHBondContact O-N 3.48Å; L1109-Q1111 VanDerWaalsContact C-N 3.31Å; L1109-Q1111 PolarHBondContact O-N 3.09Å; L1109-Q1112 PolarHBondContact O-N 2.89Å; L1109-I1114 HydrophobicContact CB-CD1 4.02Å; L1109-I1114 HydrophobicContact CD2-CD1 3.44Å; L1109-I1114 VanDerWaalsContact CD2-CD1 3.44Å; L1109-I1114 HydrophobicContact CG-CD1 4.33Å; L1109-I1114 WeakPolarHBondContact O-CD1 3.06Å; L1109-M1119 HydrophobicContact CB-CE 4.45Å; L1109-M1119 HydrophobicContact CB-SD 3.76Å; L1109-M1119 HydrophobicContact CD1-SD 4.48Å; L1109-L1122 HydrophobicContact CD1-CB 4.03Å; L1109-L1122 HydrophobicContact CD2-CB 4.45Å; L1109-L1122 HydrophobicContact CD2-CD1 4.08Å
1110	R	73.5	Confident	75.2	Confident	151 Å²	151	54.8 Å²	54.8	57%	0.57	25%	0.246	S	C	*	.	H	α-helix	trans	-68.3	-26	175.6	-77.4	-176.3	-169.7	-179.9	11.2	114	H1106 Y1107 V1108 Q1112	H1106-R1110 PolarHBondContact CD2-NE 3.47Å; H1106-R1110 PolarHBondContact CD2-NH2 3.27Å; H1106-R1110 PolarHBondContact NE2-NE 3Å; H1106-R1110 PolarHBondContact NE2-NH2 3Å; H1106-R1110 WeakPolarHBondContact O-CG 3.25Å; H1106-R1110 PolarHBondContact O-N 3.29Å; H1106-R1110 VanDerWaalsContact O-N 3.17Å; Y1107-R1110 PolarHBondContact O-N 2.98Å; V1108-R1110 PolarHBondContact O-N 3.38Å; R1110-Q1112 VanDerWaalsContact C-N 3.3Å
1111	Q	76.7	Confident	74.6	Confident	117 Å²	117	54.8 Å²	54.8	55%	0.547	25%	0.246	S	C	.	.	H	α-helix	trans	-79.4	-19.2	176.9	-58.8	-124.3	19.4	0	0	112	Y1107 V1108 L1109	Y1107-Q1111 WeakPolarHBondContact O-CG 3.43Å; Y1107-Q1111 PolarHBondContact O-N 2.82Å; Y1107-Q1111 PolarHBondContact OH-NE2 3.37Å; V1108-Q1111 WeakPolarHBondContact O-CB 3.38Å; V1108-Q1111 PolarHBondContact O-N 2.64Å; L1109-Q1111 VanDerWaalsContact C-N 3.31Å; L1109-Q1111 PolarHBondContact O-N 3.09Å
1112	Q	75.4	Confident	74.3	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	25%	0.246	S	C	.	.	S	Bend	trans	-85.8	149.8	-179.1	-60.1	-48	-41.8	0	0	112.4	I1022 F1026 V1108 L1109 R1110 I1114	I1022-Q1112 HydrophobicContact CD1-CG 4.33Å; F1026-Q1112 HydrophobicContact CE2-CG 4.33Å; F1026-Q1112 VanDerWaalsContact CZ-CD 3.48Å; V1108-Q1112 WeakPolarHBondContact O-CG 3.31Å; V1108-Q1112 PolarHBondContact O-N 2.87Å; L1109-Q1112 PolarHBondContact O-N 2.89Å; R1110-Q1112 VanDerWaalsContact C-N 3.3Å; Q1112-I1114 HydrophobicContact CB-CD1 3.86Å; Q1112-I1114 HydrophobicContact CB-CG1 3.69Å; Q1112-I1114 PolarHBondContact O-N 2.96Å
1113	K	68.9	Low	74	Confident	218 Å²	218	52.4 Å²	52.4	95%	0.948	24%	0.235	S	C	*	.			trans	-76.3	61.5	174.4	-70.1	-174.1	179.5	178.2	0	111.8
1114	I	71.5	Confident	73.8	Confident	24 Å²	24	50 Å²	50	12%	0.123	22%	0.222	C	C	.	.			trans	-87.6	142.4	178.7	-56.9	174.6	0	0	0	108.7	I1022 L1109 Q1112 P1116 W1118 M1119 L1122	I1022-I1114 HydrophobicContact CD1-CD1 3.72Å; I1022-I1114 HydrophobicContact CD1-CG1 4.3Å; L1109-I1114 HydrophobicContact CB-CD1 4.02Å; L1109-I1114 HydrophobicContact CD2-CD1 3.44Å; L1109-I1114 VanDerWaalsContact CD2-CD1 3.44Å; L1109-I1114 HydrophobicContact CG-CD1 4.33Å; L1109-I1114 WeakPolarHBondContact O-CD1 3.06Å; Q1112-I1114 HydrophobicContact CB-CD1 3.86Å; Q1112-I1114 HydrophobicContact CB-CG1 3.69Å; Q1112-I1114 PolarHBondContact O-N 2.96Å; I1114-P1116 WeakPolarHBondContact O-CD 3.45Å; I1114-W1118 HydrophobicContact CG2-CB 3.83Å; I1114-M1119 HydrophobicContact CB-CE 4.22Å; I1114-M1119 HydrophobicContact CD1-CE 4.38Å; I1114-L1122 HydrophobicContact CD1-CD1 3.78Å; I1114-L1122 HydrophobicContact CG2-CD1 3.68Å
1115	K	63.2	Low	73.7	Confident	120 Å²	120	50.6 Å²	50.6	52%	0.522	23%	0.225	S	C	.	.			trans	-59.7	124.9	171.7	-65.2	178.4	-178.9	175.3	0	108.6	H1117 W1118	K1115-H1117 PolarHBondContact O-N 3.23Å; K1115-W1118 HydrophobicContact CB-CG 4.24Å; K1115-W1118 WeakPolarHBondContact O-CB 3.31Å; K1115-W1118 PolarHBondContact O-N 3.37Å
1116	P	59.1	Low	73.7	Confident	28 Å²	28	50.7 Å²	50.7	18%	0.182	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-32.3	-171.1	-31.2	36.2	0	0	0	115	W760 T769 I1114 M1119	W760-P1116 HydrophobicContact CD2-CB 4.1Å; W760-P1116 HydrophobicContact CG-CB 4.04Å; W760-P1116 HydrophobicContact CZ2-CB 4.45Å; W760-P1116 PolarHBondContact NE1-O 2.64Å; T769-P1116 HydrophobicContact CG2-CG 4.14Å; I1114-P1116 WeakPolarHBondContact O-CD 3.45Å; P1116-M1119 VanDerWaalsContact O-CB 3.27Å; P1116-M1119 WeakPolarHBondContact O-CB 3.46Å; P1116-M1119 PolarHBondContact O-N 3.49Å
1117	H	60	Low	73.7	Confident	36 Å²	36	52.1 Å²	52.1	17%	0.167	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-24.6	177.5	68.5	-89	0	0	0	113.5	T803 K1115 M1119	T803-H1117 CarbonylContact O-C 3.45Å; T803-H1117 VanDerWaalsContact O-CB 3.3Å; T803-H1117 WeakPolarHBondContact O-CB 3.39Å; K1115-H1117 PolarHBondContact O-N 3.23Å; H1117-M1119 VanDerWaalsContact C-N 3.31Å
1118	W	74	Confident	73.6	Confident	29 Å²	29	49.4 Å²	49.4	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-72.7	-24.5	174.1	-73.8	16.8	0	0	0	112.8	E1014 R1015 T1018 I1114 K1115 F1120 S1121 L1122	E1014-W1118 HydrophobicContact CB-CH2 4.1Å; R1015-W1118 HydrophobicContact CG-CD2 4.06Å; R1015-W1118 HydrophobicContact CG-CE3 4.22Å; R1015-W1118 HydrophobicContact CG-CG 4.37Å; T1018-W1118 HydrophobicContact CG2-CZ3 4.39Å; T1018-W1118 WeakPolarHBondContact OG1-CZ3 3.4Å; I1114-W1118 HydrophobicContact CG2-CB 3.83Å; K1115-W1118 HydrophobicContact CB-CG 4.24Å; K1115-W1118 WeakPolarHBondContact O-CB 3.31Å; K1115-W1118 PolarHBondContact O-N 3.37Å; W1118-F1120 PolarHBondContact O-N 2.97Å; W1118-F1120 VanDerWaalsContact O-N 3.14Å; W1118-S1121 PolarHBondContact O-N 2.78Å; W1118-L1122 HydrophobicContact CB-CD1 4.38Å; W1118-L1122 WeakPolarHBondContact O-CG 3.34Å; W1118-L1122 PolarHBondContact O-N 2.89Å
1119	M	73.4	Confident	73.9	Confident	15 Å²	15	49.4 Å²	49.4	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-51.5	-42.8	-176	-164.3	63	68.4	0	0	112	L1109 I1114 P1116 H1117 S1121 L1122 D1123	L1109-M1119 HydrophobicContact CB-CE 4.45Å; L1109-M1119 HydrophobicContact CB-SD 3.76Å; L1109-M1119 HydrophobicContact CD1-SD 4.48Å; I1114-M1119 HydrophobicContact CB-CE 4.22Å; I1114-M1119 HydrophobicContact CD1-CE 4.38Å; P1116-M1119 VanDerWaalsContact O-CB 3.27Å; P1116-M1119 WeakPolarHBondContact O-CB 3.46Å; P1116-M1119 PolarHBondContact O-N 3.49Å; H1117-M1119 VanDerWaalsContact C-N 3.31Å; M1119-S1121 PolarHBondContact O-N 3.35Å; M1119-L1122 PolarHBondContact O-N 3.06Å; M1119-D1123 WeakPolarHBondContact O-CB 3.23Å; M1119-D1123 PolarHBondContact O-N 3.4Å
1120	F	65.2	Low	74.1	Confident	43 Å²	43	49.7 Å²	49.7	19%	0.189	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-43.8	176.8	-106.8	-81	0	0	0	113.7	L755 K759 T803 W1118 N1124	L755-F1120 HydrophobicContact CD2-CD2 4.11Å; L755-F1120 HydrophobicContact CD2-CE2 3.4Å; L755-F1120 VanDerWaalsContact CD2-CE2 3.4Å; L755-F1120 HydrophobicContact CD2-CZ 4.32Å; K759-F1120 HydrophobicContact CB-CE2 4.41Å; K759-F1120 HydrophobicContact CD-CE2 4.21Å; K759-F1120 HydrophobicContact CD-CZ 4.36Å; K759-F1120 HydrophobicContact CG-CD2 4.45Å; K759-F1120 HydrophobicContact CG-CE2 3.68Å; K759-F1120 HydrophobicContact CG-CZ 4.07Å; T803-F1120 HydrophobicContact CG2-CD2 3.8Å; T803-F1120 HydrophobicContact CG2-CE2 4.34Å; T803-F1120 HydrophobicContact CG2-CG 4.39Å; W1118-F1120 PolarHBondContact O-N 2.97Å; W1118-F1120 VanDerWaalsContact O-N 3.14Å; F1120-N1124 VanDerWaalsContact O-CB 3.28Å; F1120-N1124 WeakPolarHBondContact O-CB 3.5Å; F1120-N1124 VanDerWaalsContact O-CG 3.23Å; F1120-N1124 PolarHBondContact O-N 3.4Å; F1120-N1124 PolarHBondContact O-ND2 3.24Å
1121	S	71.3	Confident	74.5	Confident	8 Å²	8	47 Å²	47	6%	0.056	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-40.6	-179.7	-67.3	0	0	0	0	110.8	R1015 W1118 M1119 N1124 L1125	R1015-S1121 PolarHBondContact NH1-OG 2.94Å; W1118-S1121 PolarHBondContact O-N 2.78Å; M1119-S1121 PolarHBondContact O-N 3.35Å; S1121-N1124 PolarHBondContact O-N 3.37Å; S1121-L1125 WeakPolarHBondContact O-CB 3.46Å; S1121-L1125 WeakPolarHBondContact O-CG 3.36Å; S1121-L1125 PolarHBondContact O-N 3.47Å
1122	L	79.8	Confident	74.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-41.2	178.1	-59.1	174.8	0	0	0	111.8	R1015 L1019 L1109 I1114 W1118 M1119 L1125 T1126	R1015-L1122 HydrophobicContact CB-CD2 4.1Å; R1015-L1122 WeakPolarHBondContact O-CD2 3.45Å; L1019-L1122 HydrophobicContact CB-CD2 3.81Å; L1019-L1122 HydrophobicContact CD1-CB 4.31Å; L1019-L1122 HydrophobicContact CD1-CD2 4.44Å; L1109-L1122 HydrophobicContact CD1-CB 4.03Å; L1109-L1122 HydrophobicContact CD2-CB 4.45Å; L1109-L1122 HydrophobicContact CD2-CD1 4.08Å; I1114-L1122 HydrophobicContact CD1-CD1 3.78Å; I1114-L1122 HydrophobicContact CG2-CD1 3.68Å; W1118-L1122 HydrophobicContact CB-CD1 4.38Å; W1118-L1122 WeakPolarHBondContact O-CG 3.34Å; W1118-L1122 PolarHBondContact O-N 2.89Å; M1119-L1122 PolarHBondContact O-N 3.06Å; L1122-L1125 HydrophobicContact CD2-CD1 4.43Å; L1122-L1125 PolarHBondContact O-N 3.06Å; L1122-T1126 WeakPolarHBondContact O-CB 3.06Å; L1122-T1126 PolarHBondContact O-N 3.35Å; L1122-T1126 PolarHBondContact O-OG1 2.92Å
1123	D	73.9	Confident	75.2	Confident	4 Å²	4	39 Å²	39	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-45.5	174.4	-163.1	24.6	0	0	0	110.7	K759 Q1102 H1106 M1119 L1125 T1126 Q1127	K759-D1123 IonicContact NZ-OD2 3.39Å; K759-D1123 PolarHBondContact NZ-OD2 3.1Å; Q1102-D1123 PolarHBondContact NE2-OD1 3.11Å; H1106-D1123 IonicContact CE1-OD2 3.48Å; H1106-D1123 PolarHBondContact CE1-OD2 3.45Å; H1106-D1123 IonicContact ND1-OD1 2.65Å; H1106-D1123 PolarHBondContact ND1-OD1 3.3Å; H1106-D1123 IonicContact ND1-OD2 3.33Å; H1106-D1123 PolarHBondContact ND1-OD2 3.3Å; M1119-D1123 WeakPolarHBondContact O-CB 3.23Å; M1119-D1123 PolarHBondContact O-N 3.4Å; D1123-L1125 PolarHBondContact O-N 3.46Å; D1123-T1126 WeakPolarHBondContact O-CB 3.35Å; D1123-T1126 PolarHBondContact O-N 3.15Å; D1123-Q1127 WeakPolarHBondContact O-CB 3.32Å; D1123-Q1127 PolarHBondContact O-N 3.06Å
1124	N	74.1	Confident	75.7	Confident	57 Å²	57	31 Å²	31	31%	0.305	16%	0.155	S	C	.	.	H	α-helix	trans	-64.2	-38.4	174.9	-77.1	-14.8	0	0	0	113	F1120 S1121 T1126 Q1127 S1128	F1120-N1124 VanDerWaalsContact O-CB 3.28Å; F1120-N1124 WeakPolarHBondContact O-CB 3.5Å; F1120-N1124 VanDerWaalsContact O-CG 3.23Å; F1120-N1124 PolarHBondContact O-N 3.4Å; F1120-N1124 PolarHBondContact O-ND2 3.24Å; S1121-N1124 PolarHBondContact O-N 3.37Å; N1124-T1126 VanDerWaalsContact C-N 3.34Å; N1124-Q1127 PolarHBondContact O-N 3.2Å; N1124-S1128 VanDerWaalsContact O-CB 3.23Å; N1124-S1128 WeakPolarHBondContact O-CB 3.36Å; N1124-S1128 PolarHBondContact O-N 3.2Å
1125	L	83.2	Confident	76	Confident	16 Å²	16	35.1 Å²	35.1	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-43.2	175	-73.9	171.6	0	0	0	110.9	R1015 R1016 L1019 S1121 L1122 D1123 S1128 C1129	R1015-L1125 HydrophobicContact CB-CD1 4.24Å; R1016-L1125 HydrophobicContact CG-CD1 3.88Å; R1016-L1125 HydrophobicContact CG-CD2 4.08Å; L1019-L1125 HydrophobicContact CD2-CB 3.56Å; L1019-L1125 HydrophobicContact CD2-CD1 4.33Å; S1121-L1125 WeakPolarHBondContact O-CB 3.46Å; S1121-L1125 WeakPolarHBondContact O-CG 3.36Å; S1121-L1125 PolarHBondContact O-N 3.47Å; L1122-L1125 HydrophobicContact CD2-CD1 4.43Å; L1122-L1125 PolarHBondContact O-N 3.06Å; D1123-L1125 PolarHBondContact O-N 3.46Å; L1125-S1128 PolarHBondContact O-N 2.76Å; L1125-C1129 VanDerWaalsContact O-CB 3.27Å; L1125-C1129 WeakPolarHBondContact O-CB 3.49Å; L1125-C1129 PolarHBondContact O-N 2.73Å
1126	T	84.5	Confident	76.8	Confident	2 Å²	2	30 Å²	30	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-45.9	175.8	-55.1	0	0	0	0	111	F1101 M1105 L1122 D1123 N1124 C1129 S1130	F1101-T1126 HydrophobicContact CD1-CG2 3.93Å; F1101-T1126 HydrophobicContact CE1-CG2 3.81Å; M1105-T1126 HydrophobicContact CB-CG2 3.7Å; M1105-T1126 HydrophobicContact CG-CG2 3.69Å; L1122-T1126 WeakPolarHBondContact O-CB 3.06Å; L1122-T1126 PolarHBondContact O-N 3.35Å; L1122-T1126 PolarHBondContact O-OG1 2.92Å; D1123-T1126 WeakPolarHBondContact O-CB 3.35Å; D1123-T1126 PolarHBondContact O-N 3.15Å; N1124-T1126 VanDerWaalsContact C-N 3.34Å; T1126-C1129 PolarHBondContact O-N 3.17Å; T1126-S1130 WeakPolarHBondContact O-CB 3.35Å; T1126-S1130 PolarHBondContact O-N 2.64Å; T1126-S1130 PolarHBondContact O-OG 2.92Å
1127	Q	78.1	Confident	77.6	Confident	49 Å²	49	29.2 Å²	29.2	23%	0.229	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-45.3	178	-170.5	-177.4	22.2	0	0	112	D1123 N1124 C1129 S1130 K1131	D1123-Q1127 WeakPolarHBondContact O-CB 3.32Å; D1123-Q1127 PolarHBondContact O-N 3.06Å; N1124-Q1127 PolarHBondContact O-N 3.2Å; Q1127-C1129 VanDerWaalsContact C-N 3.28Å; Q1127-C1129 PolarHBondContact O-N 3.21Å; Q1127-S1130 PolarHBondContact O-N 2.8Å; Q1127-K1131 WeakPolarHBondContact O-CB 3.44Å; Q1127-K1131 PolarHBondContact O-N 3.45Å
1128	S	78.3	Confident	78.1	Confident	63 Å²	63	29.8 Å²	29.8	44%	0.441	16%	0.155	S	C	.	.	H	α-helix	trans	-61.2	-39.4	177.2	-177.8	0	0	0	0	111.5	N1124 L1125 C1132	N1124-S1128 VanDerWaalsContact O-CB 3.23Å; N1124-S1128 WeakPolarHBondContact O-CB 3.36Å; N1124-S1128 PolarHBondContact O-N 3.2Å; L1125-S1128 PolarHBondContact O-N 2.76Å; S1128-C1132 WeakPolarHBondContact O-CB 3.28Å; S1128-C1132 PolarHBondContact O-N 3.25Å; S1128-C1132 VanDerWaalsContact O-N 3.11Å
1129	C	86.4	Confident	77	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-53.4	174.9	-174.6	0	0	0	0	110.5	M1061 Y1064 V1065 L1125 T1126 Q1127 K1131 C1132 F1133	M1061-C1129 VanDerWaalsContact CA-SG 3.56Å; M1061-C1129 WeakPolarHBondContact CB-SG 3.35Å; M1061-C1129 HydrophobicContact CE-CB 4.19Å; M1061-C1129 VanDerWaalsContact CE-SG 3.55Å; M1061-C1129 VanDerWaalsContact CG-SG 3.56Å; Y1064-C1129 HydrophobicContact CD1-CB 3.95Å; Y1064-C1129 HydrophobicContact CE1-CB 4.23Å; V1065-C1129 HydrophobicContact CG2-CB 4.12Å; L1125-C1129 VanDerWaalsContact O-CB 3.27Å; L1125-C1129 WeakPolarHBondContact O-CB 3.49Å; L1125-C1129 PolarHBondContact O-N 2.73Å; T1126-C1129 PolarHBondContact O-N 3.17Å; Q1127-C1129 VanDerWaalsContact C-N 3.28Å; Q1127-C1129 PolarHBondContact O-N 3.21Å; C1129-K1131 PolarHBondContact O-N 3.42Å; C1129-C1132 WeakPolarHBondContact O-CB 3.47Å; C1129-C1132 PolarHBondContact O-N 3.34Å; C1129-C1132 VanDerWaalsContact O-N 3.07Å; C1129-F1133 WeakPolarHBondContact O-CD2 3.34Å; C1129-F1133 PolarHBondContact O-N 3.37Å; C1129-F1133 VanDerWaalsContact O-N 3.16Å
1130	S	85.3	Confident	75.6	Confident	6 Å²	6	37.1 Å²	37.1	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-46.2	-179.9	-50.9	0	0	0	0	112.1	T1126 Q1127 C1132 F1133 I1134	T1126-S1130 WeakPolarHBondContact O-CB 3.35Å; T1126-S1130 PolarHBondContact O-N 2.64Å; T1126-S1130 PolarHBondContact O-OG 2.92Å; Q1127-S1130 PolarHBondContact O-N 2.8Å; S1130-C1132 PolarHBondContact O-N 2.91Å; S1130-F1133 PolarHBondContact O-N 2.69Å; S1130-I1134 VanDerWaalsContact O-CG1 3.28Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.44Å; S1130-I1134 PolarHBondContact O-N 3.48Å
1131	K	81.2	Confident	74.5	Confident	95 Å²	95	38.4 Å²	38.4	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-56.9	-44.4	174.3	-84.2	-172	171.5	-174.1	0	112.3	Q1127 C1129 F1133 I1134 E1135 E1162	Q1127-K1131 WeakPolarHBondContact O-CB 3.44Å; Q1127-K1131 PolarHBondContact O-N 3.45Å; C1129-K1131 PolarHBondContact O-N 3.42Å; K1131-F1133 VanDerWaalsContact C-N 3.35Å; K1131-F1133 PolarHBondContact O-N 3.39Å; K1131-I1134 PolarHBondContact O-N 3.3Å; K1131-E1135 WeakPolarHBondContact O-CB 3.33Å; K1131-E1135 PolarHBondContact O-N 2.87Å; K1131-E1162 IonicContact NZ-OE2 3.7Å; K1131-E1162 PolarHBondContact NZ-OE2 3.16Å
1132	C	82.6	Confident	73	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.034	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-42.9	179.6	-172.3	0	0	0	0	111.7	Y1064 S1128 C1129 S1130 L1136	Y1064-C1132 HydrophobicContact CE1-CB 4.18Å; Y1064-C1132 HydrophobicContact CE2-CB 4.43Å; S1128-C1132 WeakPolarHBondContact O-CB 3.28Å; S1128-C1132 PolarHBondContact O-N 3.25Å; S1128-C1132 VanDerWaalsContact O-N 3.11Å; C1129-C1132 WeakPolarHBondContact O-CB 3.47Å; C1129-C1132 PolarHBondContact O-N 3.34Å; C1129-C1132 VanDerWaalsContact O-N 3.07Å; S1130-C1132 PolarHBondContact O-N 2.91Å; C1132-L1136 VanDerWaalsContact O-CG 3.24Å; C1132-L1136 WeakPolarHBondContact O-CG 3.4Å; C1132-L1136 PolarHBondContact O-N 3.39Å; C1132-L1136 VanDerWaalsContact O-N 3.14Å
1133	F	84.3	Confident	70.9	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-70.9	-37.2	179	-80	-94.6	0	0	0	112.3	L1057 A1060 M1061 Y1064 A1073 F1076 V1077 L1098 C1129 S1130 K1131 L1136 L1137	L1057-F1133 HydrophobicContact CD1-CD1 3.88Å; L1057-F1133 HydrophobicContact CD1-CE1 4.2Å; A1060-F1133 HydrophobicContact CB-CE1 3.98Å; A1060-F1133 HydrophobicContact CB-CZ 3.86Å; M1061-F1133 HydrophobicContact CB-CE2 4.31Å; M1061-F1133 HydrophobicContact CG-CD2 3.82Å; M1061-F1133 HydrophobicContact CG-CE2 3.64Å; M1061-F1133 HydrophobicContact CG-CG 4.39Å; M1061-F1133 HydrophobicContact CG-CZ 4.06Å; Y1064-F1133 HydrophobicContact CG-CE2 4.33Å; A1073-F1133 HydrophobicContact CB-CE1 4.31Å; A1073-F1133 HydrophobicContact CB-CE2 4.26Å; A1073-F1133 HydrophobicContact CB-CZ 3.91Å; F1076-F1133 AromaticContact CD1-CE1 3.88Å; F1076-F1133 HydrophobicContact CD1-CE1 3.88Å; F1076-F1133 HydrophobicContact CE1-CE1 4.45Å; V1077-F1133 HydrophobicContact CG2-CD1 3.88Å; V1077-F1133 HydrophobicContact CG2-CE1 4.29Å; L1098-F1133 HydrophobicContact CD1-CB 3.61Å; L1098-F1133 HydrophobicContact CD2-CB 3.91Å; L1098-F1133 HydrophobicContact CG-CB 4.43Å; C1129-F1133 WeakPolarHBondContact O-CD2 3.34Å; C1129-F1133 PolarHBondContact O-N 3.37Å; C1129-F1133 VanDerWaalsContact O-N 3.16Å; S1130-F1133 PolarHBondContact O-N 2.69Å; K1131-F1133 VanDerWaalsContact C-N 3.35Å; K1131-F1133 PolarHBondContact O-N 3.39Å; F1133-L1136 PolarHBondContact O-N 2.94Å; F1133-L1137 WeakPolarHBondContact O-CD1 3.28Å; F1133-L1137 WeakPolarHBondContact O-CG 3.42Å; F1133-L1137 PolarHBondContact O-N 2.83Å
1134	I	81	Confident	69	Low	48 Å²	48	55.7 Å²	55.7	25%	0.246	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-43.1	174.1	-65.8	165.5	0	0	0	111.2	L1098 S1130 K1131 L1136 L1137 S1138	L1098-I1134 HydrophobicContact CB-CD1 3.96Å; L1098-I1134 HydrophobicContact CB-CG1 3.65Å; L1098-I1134 HydrophobicContact CD1-CG1 3.95Å; L1098-I1134 HydrophobicContact CG-CG1 4.45Å; S1130-I1134 VanDerWaalsContact O-CG1 3.28Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.44Å; S1130-I1134 PolarHBondContact O-N 3.48Å; K1131-I1134 PolarHBondContact O-N 3.3Å; I1134-L1136 VanDerWaalsContact C-N 3.34Å; I1134-L1136 PolarHBondContact O-N 3.27Å; I1134-L1137 PolarHBondContact O-N 3.21Å; I1134-S1138 PolarHBondContact O-N 2.91Å; I1134-S1138 PolarHBondContact O-OG 3.14Å
1135	E	78.1	Confident	66.9	Low	111 Å²	111	60.8 Å²	60.8	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-42.9	177	-171.6	-173.7	177.5	0	0	111.3	K1070 K1131 S1138	K1070-E1135 IonicContact NZ-OE2 2.8Å; K1131-E1135 WeakPolarHBondContact O-CB 3.33Å; K1131-E1135 PolarHBondContact O-N 2.87Å; E1135-S1138 PolarHBondContact O-N 3.48Å
1136	L	79.8	Confident	64.3	Low	14 Å²	14	63.1 Å²	63.1	7%	0.073	38%	0.38	C	S	.	.	H	α-helix	trans	-71.2	-27.1	179.2	-69.1	177.3	0	0	0	113.8	A1073 R1074 V1077 K1081 C1132 F1133 I1134	A1073-L1136 HydrophobicContact CB-CD1 3.8Å; R1074-L1136 HydrophobicContact CG-CD1 3.94Å; R1074-L1136 HydrophobicContact CG-CD2 3.39Å; R1074-L1136 HydrophobicContact CG-CG 4.29Å; V1077-L1136 HydrophobicContact CB-CB 4.32Å; V1077-L1136 HydrophobicContact CG1-CB 4.2Å; V1077-L1136 HydrophobicContact CG2-CB 3.95Å; V1077-L1136 HydrophobicContact CG2-CD1 4.31Å; K1081-L1136 PolarHBondContact NZ-O 2.91Å; C1132-L1136 VanDerWaalsContact O-CG 3.24Å; C1132-L1136 WeakPolarHBondContact O-CG 3.4Å; C1132-L1136 PolarHBondContact O-N 3.39Å; C1132-L1136 VanDerWaalsContact O-N 3.14Å; F1133-L1136 PolarHBondContact O-N 2.94Å; I1134-L1136 VanDerWaalsContact C-N 3.34Å; I1134-L1136 PolarHBondContact O-N 3.27Å
1137	L	76	Confident	61.6	Low	11 Å²	11	71.7 Å²	71.7	6%	0.058	42%	0.42	C	S	.	.	H	α-helix	trans	-76.5	-29.7	176.5	-75.5	162.4	0	0	0	112.3	V1077 K1081 L1091 V1094 L1098 F1133 I1134	V1077-L1137 HydrophobicContact CG1-CD2 3.85Å; V1077-L1137 HydrophobicContact CG1-CG 4.15Å; K1081-L1137 PolarHBondContact NZ-O 3.4Å; K1081-L1137 VanDerWaalsContact NZ-O 3.1Å; L1091-L1137 HydrophobicContact CD2-CD2 3.85Å; V1094-L1137 HydrophobicContact CB-CD1 4.47Å; V1094-L1137 HydrophobicContact CG1-CD1 3.68Å; L1098-L1137 HydrophobicContact CD1-CD1 3.44Å; L1098-L1137 VanDerWaalsContact CD1-CD1 3.44Å; F1133-L1137 WeakPolarHBondContact O-CD1 3.28Å; F1133-L1137 WeakPolarHBondContact O-CG 3.42Å; F1133-L1137 PolarHBondContact O-N 2.83Å; I1134-L1137 PolarHBondContact O-N 3.21Å
1138	S	69	Low	59.2	Low	47 Å²	47	75 Å²	75	33%	0.329	45%	0.446	S	S	.	.	S	Bend	trans	-63.8	142.9	-175.3	-63.6	0	0	0	0	113.7	I1134 E1135 A1140	I1134-S1138 PolarHBondContact O-N 2.91Å; I1134-S1138 PolarHBondContact O-OG 3.14Å; E1135-S1138 PolarHBondContact O-N 3.48Å; S1138-A1140 PolarHBondContact O-N 2.93Å; S1138-A1140 VanDerWaalsContact O-N 3.07Å
1139	P	50.8	Low	56.5	Low	104 Å²	104	80.2 Å²	80.2	68%	0.675	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-60.8	-22.7	-172.4	-23.8	32.1	0	0	0	115.8	V1141 Q1142	P1139-V1141 PolarHBondContact O-N 2.89Å; P1139-Q1142 PolarHBondContact O-N 3.13Å
1140	A	45.4	Very low	53.6	Low	95 Å²	95	88.9 Å²	88.9	79%	0.785	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-63.5	-15.9	-173.8	0	0	0	0	0	114.8	S1138	S1138-A1140 PolarHBondContact O-N 2.93Å; S1138-A1140 VanDerWaalsContact O-N 3.07Å
1141	V	41.3	Very low	50.7	Low	70 Å²	70	95.3 Å²	95.3	42%	0.424	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-84.8	-6	-178.5	-173.8	0	0	0	0	112.8	P1139 N1143	P1139-V1141 PolarHBondContact O-N 2.89Å; V1141-N1143 VanDerWaalsContact C-N 3.33Å; V1141-N1143 PolarHBondContact O-N 2.95Å
1142	Q	39.9	Very low	47.9	Very low	133 Å²	133	94.9 Å²	94.9	62%	0.621	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-69.8	-22.1	179.6	-77.9	179.8	-19.2	0	0	114.8	P1139	P1139-Q1142 PolarHBondContact O-N 3.13Å
1143	N	35.1	Very low	45	Very low	160 Å²	160	97.6 Å²	97.6	86%	0.856	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-92.7	10	-173.6	-77.9	-12.4	0	0	0	115.2	V1141	V1141-N1143 VanDerWaalsContact C-N 3.33Å; V1141-N1143 PolarHBondContact O-N 2.95Å
1144	A	35	Very low	42.1	Very low	82 Å²	82	105.9 Å²	105.9	68%	0.678	63%	0.633	S	S	*	*			trans	-103.9	45.7	176.2	0	0	0	0	0	112.2	G1146	A1144-G1146 PolarHBondContact O-N 2.93Å; A1144-G1146 VanDerWaalsContact O-N 3.16Å
1145	N	29.8	Very low	39.3	Very low	164 Å²	164	108.1 Å²	108.1	88%	0.877	65%	0.653	S	S	*	*			trans	-82.4	46.1	166.5	-80.9	-10.2	0	0	0	111.4
1146	G	27.7	Very low	36.7	Very low	64 Å²	64	108.4 Å²	108.4	66%	0.66	67%	0.667	S	S	*	*			trans	-108.6	117.7	173.9	0	0	0	0	0	109.8	A1144	A1144-G1146 PolarHBondContact O-N 2.93Å; A1144-G1146 VanDerWaalsContact O-N 3.16Å
1147	E	28.1	Very low	33.9	Very low	182 Å²	182	112.3 Å²	112.3	85%	0.85	70%	0.696	S	S	*	*			trans	-46.2	151.3	174.7	-70.3	-174.1	153.1	0	0	113.6	Q1149	E1147-Q1149 PolarHBondContact O-N 3.45Å
1148	P	27.8	Very low	31.5	Very low	119 Å²	119	119.7 Å²	119.7	77%	0.773	72%	0.724	S	S	*	*			trans	-71.3	102.4	-166.8	28.8	-33.1	0	0	0	110.8	E1150	P1148-E1150 PolarHBondContact O-N 3.33Å; P1148-E1150 VanDerWaalsContact O-N 3.08Å
1149	Q	23.2	Very low	29.4	Very low	173 Å²	173	121.9 Å²	121.9	81%	0.808	75%	0.745	S	S	*	*			trans	-77.6	94.7	165.9	-142.1	173.7	7	0	0	108.3	E1147 N1151	E1147-Q1149 PolarHBondContact O-N 3.45Å; Q1149-N1151 VanDerWaalsContact C-N 3.31Å; Q1149-N1151 PolarHBondContact O-N 2.85Å
1150	E	24.7	Very low	28	Very low	183 Å²	183	122 Å²	122	86%	0.855	75%	0.749	S	S	*	*			trans	-58.9	89.3	166.1	-70.5	-173.9	156.3	0	0	109.7	P1148	P1148-E1150 PolarHBondContact O-N 3.33Å; P1148-E1150 VanDerWaalsContact O-N 3.08Å
1151	N	24.3	Very low	27	Very low	141 Å²	141	123.3 Å²	123.3	75%	0.754	75%	0.747	S	S	*	*			trans	-104.2	98.4	156.3	-84.8	-20.7	0	0	0	107.7	Q1149 G1153	Q1149-N1151 VanDerWaalsContact C-N 3.31Å; Q1149-N1151 PolarHBondContact O-N 2.85Å; N1151-G1153 PolarHBondContact O-N 2.76Å
1152	G	21.6	Very low	26.1	Very low	87 Å²	87	126.6 Å²	126.6	90%	0.897	76%	0.758	S	S	*	*			trans	-55	118.1	170	0	0	0	0	0	110.8
1153	G	22	Very low	25.5	Very low	61 Å²	61	125.6 Å²	125.6	63%	0.629	75%	0.753	S	S	*	*			trans	-146.2	99.3	163.4	0	0	0	0	0	106.2	N1151 S1155	N1151-G1153 PolarHBondContact O-N 2.76Å; G1153-S1155 PolarHBondContact O-N 3.27Å
1154	D	22.8	Very low	25	Very low	174 Å²	174	121.3 Å²	121.3	93%	0.93	74%	0.739	S	S	*	*			trans	-50.8	102.8	170.6	-82.5	-40.4	0	0	0	109.1
1155	S	23.3	Very low	24.5	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	74%	0.736	S	S	*	*			trans	-140.6	74.9	171.3	-81	0	0	0	0	108.3	G1153 S1157	G1153-S1155 PolarHBondContact O-N 3.27Å; S1155-S1157 PolarHBondContact O-N 2.93Å
1156	S	23.3	Very low	24.2	Very low	116 Å²	116	122.1 Å²	122.1	81%	0.811	74%	0.735	S	S	*	*			trans	-66.9	56.9	152.2	57.7	0	0	0	0	110.1
1157	S	21.8	Very low	24	Very low	97 Å²	97	124.3 Å²	124.3	68%	0.678	74%	0.738	S	S	*	*			trans	-97.1	119.9	169.9	81.5	0	0	0	0	108.1	S1155 A1159	S1155-S1157 PolarHBondContact O-N 2.93Å; S1157-A1159 PolarHBondContact O-N 2.86Å
1158	Y	24.9	Very low	23.8	Very low	166 Å²	166	121 Å²	121	65%	0.651	73%	0.734	S	S	*	*			trans	-52.6	119.9	-177.4	-83.8	-102.9	0	0	0	111	R1005 S1160	R1005-Y1158 VanDerWaalsContact CZ-OH 3.3Å; R1005-Y1158 PolarHBondContact NE-OH 3.47Å; R1005-Y1158 PolarHBondContact NH2-OH 3.35Å; R1005-Y1158 VanDerWaalsContact NH2-OH 3.16Å; Y1158-S1160 PolarHBondContact O-N 3.43Å; Y1158-S1160 VanDerWaalsContact O-N 3.09Å
1159	A	24.1	Very low	23.6	Very low	93 Å²	93	120.9 Å²	120.9	77%	0.769	73%	0.732	S	S	*	*			trans	-59.8	111	166.2	0	0	0	0	0	109.1	S1157 T1161	S1157-A1159 PolarHBondContact O-N 2.86Å; A1159-T1161 PolarHBondContact O-N 2.91Å
1160	S	22.2	Very low	23.6	Very low	106 Å²	106	116.7 Å²	116.7	74%	0.741	72%	0.719	S	S	*	*			trans	-52.8	122.5	169.6	-57.1	0	0	0	0	109.4	Y1158 E1162	Y1158-S1160 PolarHBondContact O-N 3.43Å; Y1158-S1160 VanDerWaalsContact O-N 3.09Å; S1160-E1162 PolarHBondContact O-N 2.85Å
1161	T	23.9	Very low	23.7	Very low	123 Å²	123	116.1 Å²	116.1	76%	0.755	72%	0.72	S	S	*	*			trans	-80.5	111.2	177.7	4.2	0	0	0	0	107.4	A1159 H1163	A1159-T1161 PolarHBondContact O-N 2.91Å; T1161-H1163 PolarHBondContact O-N 3.45Å; T1161-H1163 VanDerWaalsContact O-N 3.14Å
1162	E	22.9	Very low	23.6	Very low	138 Å²	138	117.2 Å²	117.2	65%	0.645	72%	0.719	S	S	*	*			trans	-50.5	118.3	175.1	-74.8	-175.1	147.2	0	0	111.1	K1131 S1160	K1131-E1162 IonicContact NZ-OE2 3.7Å; K1131-E1162 PolarHBondContact NZ-OE2 3.16Å; S1160-E1162 PolarHBondContact O-N 2.85Å
1163	H	26.9	Very low	23.8	Very low	113 Å²	113	117.6 Å²	117.6	52%	0.523	71%	0.708	S	S	.	*			trans	-68.6	128.4	175.9	-76.6	-70.3	0	0	0	111.6	E664 T1161 K1165	E664-H1163 IonicContact OE1-CD2 3.85Å; T1161-H1163 PolarHBondContact O-N 3.45Å; T1161-H1163 VanDerWaalsContact O-N 3.14Å; H1163-K1165 PolarHBondContact O-N 2.78Å; H1163-K1165 VanDerWaalsContact O-N 3.16Å
1164	A	24.6	Very low	24.3	Very low	69 Å²	69	124.3 Å²	124.3	57%	0.57	72%	0.715	S	S	*	*			trans	-60.2	109.2	179.1	0	0	0	0	0	112.6
1165	K	23.8	Very low	24.6	Very low	142 Å²	142	124.2 Å²	124.2	62%	0.617	71%	0.71	S	S	*	*			trans	-91.5	121.1	151.3	-76.2	173.8	-179.6	165.4	0	107.1	D666 H1163 P1167	D666-K1165 IonicContact OD2-NZ 3.65Å; D666-K1165 PolarHBondContact OD2-NZ 2.92Å; H1163-K1165 PolarHBondContact O-N 2.78Å; H1163-K1165 VanDerWaalsContact O-N 3.16Å; K1165-P1167 VanDerWaalsContact O-CD 3.23Å; K1165-P1167 WeakPolarHBondContact O-CD 3.45Å
1166	S	23.6	Very low	25.1	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	70%	0.701	S	S	*	*			trans	-67	113.9	164.9	-61	0	0	0	0	108.3	S1168	S1166-S1168 PolarHBondContact O-N 3.39Å
1167	P	24.9	Very low	25.5	Very low	110 Å²	110	127.2 Å²	127.2	71%	0.714	70%	0.703	S	S	*	*			trans	-75.7	124.9	173.9	0	17.7	0	0	0	108.2	K1165 V1169	K1165-P1167 VanDerWaalsContact O-CD 3.23Å; K1165-P1167 WeakPolarHBondContact O-CD 3.45Å; P1167-V1169 PolarHBondContact O-N 2.93Å; P1167-V1169 VanDerWaalsContact O-N 3.11Å
1168	S	22.5	Very low	25.9	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	71%	0.708	S	S	*	*			trans	-60	107.8	157.5	48.9	0	0	0	0	107.5	S1166 P1170	S1166-S1168 PolarHBondContact O-N 3.39Å; S1168-P1170 WeakPolarHBondContact O-CD 3.42Å
1169	V	24.9	Very low	26.3	Very low	118 Å²	118	126.6 Å²	126.6	72%	0.715	70%	0.704	S	S	*	*			trans	-66.7	114.9	-176.5	179.2	0	0	0	0	110	P1167	P1167-V1169 PolarHBondContact O-N 2.93Å; P1167-V1169 VanDerWaalsContact O-N 3.11Å
1170	P	23.3	Very low	27	Very low	84 Å²	84	126.8 Å²	126.8	55%	0.545	70%	0.695	S	S	.	*			trans	-87.9	133.4	158.4	7.1	16	0	0	0	107.6	S1168 F1172	S1168-P1170 WeakPolarHBondContact O-CD 3.42Å; P1170-F1172 HydrophobicContact CB-CD2 3.79Å; P1170-F1172 HydrophobicContact CB-CE2 3.6Å; P1170-F1172 HydrophobicContact CG-CD2 4.08Å; P1170-F1172 HydrophobicContact CG-CE2 3.83Å; P1170-F1172 WeakPolarHBondContact O-CD2 3.46Å; P1170-F1172 PolarHBondContact O-N 3.47Å
1171	I	25.2	Very low	27.8	Very low	172 Å²	172	124.6 Å²	124.6	88%	0.882	69%	0.689	S	S	*	*			trans	-63.5	103.5	177.7	-59.5	162	0	0	0	107.6
1172	F	24	Very low	28.5	Very low	163 Å²	163	125.3 Å²	125.3	72%	0.715	69%	0.688	S	S	*	*			trans	-115.4	120.4	178.4	-89.1	-75	0	0	0	110.6	P1170	P1170-F1172 HydrophobicContact CB-CD2 3.79Å; P1170-F1172 HydrophobicContact CB-CE2 3.6Å; P1170-F1172 HydrophobicContact CG-CD2 4.08Å; P1170-F1172 HydrophobicContact CG-CE2 3.83Å; P1170-F1172 WeakPolarHBondContact O-CD2 3.46Å; P1170-F1172 PolarHBondContact O-N 3.47Å
1173	S	25.2	Very low	29.1	Very low	96 Å²	96	124.9 Å²	124.9	67%	0.671	69%	0.689	S	S	*	*			trans	-79.5	161.7	177.2	63.4	0	0	0	0	112.8	E1175	S1173-E1175 VanDerWaalsContact C-N 3.32Å; S1173-E1175 PolarHBondContact O-N 2.83Å; S1173-E1175 VanDerWaalsContact O-N 3.08Å
1174	Y	32.6	Very low	30	Very low	201 Å²	201	121.4 Å²	121.4	79%	0.788	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-57.4	-19.6	-163.1	-161.5	-106.6	0	0	0	117.7	V1176	Y1174-V1176 PolarHBondContact O-N 3Å
1175	E	29.1	Very low	31.3	Very low	173 Å²	173	120.9 Å²	120.9	81%	0.808	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-79.2	-13.9	-168.4	-68.8	-174.4	158.4	0	0	115.9	S1173 F1177	S1173-E1175 VanDerWaalsContact C-N 3.32Å; S1173-E1175 PolarHBondContact O-N 2.83Å; S1173-E1175 VanDerWaalsContact O-N 3.08Å; E1175-F1177 PolarHBondContact O-N 3.44Å
1176	V	32.9	Very low	32.8	Very low	80 Å²	80	118.4 Å²	118.4	49%	0.485	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-82.3	-12	-173.4	-176.2	0	0	0	0	113.6	Y1174 H1178 V1180	Y1174-V1176 PolarHBondContact O-N 3Å; V1176-H1178 VanDerWaalsContact C-N 3.28Å; V1176-H1178 PolarHBondContact O-N 3.1Å; V1176-V1180 HydrophobicContact CG1-CG2 4.08Å
1177	F	32.5	Very low	34.5	Very low	195 Å²	195	116.4 Å²	116.4	86%	0.855	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-65.8	-24.9	-175.1	-102.8	-87.7	0	0	0	114.5	E1175	E1175-F1177 PolarHBondContact O-N 3.44Å
1178	H	30.7	Very low	36.5	Very low	168 Å²	168	119.3 Å²	119.3	78%	0.778	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-87.7	-25.8	-173.8	-122.4	-76.8	0	0	0	114.6	V1176	V1176-H1178 VanDerWaalsContact C-N 3.28Å; V1176-H1178 PolarHBondContact O-N 3.1Å
1179	S	32.6	Very low	38.7	Very low	81 Å²	81	120 Å²	120	57%	0.566	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-26.4	-171.9	-47.6	0	0	0	0	114.1
1180	V	38.8	Very low	40.8	Very low	98 Å²	98	117.9 Å²	117.9	59%	0.594	62%	0.621	S	S	*	*	H	α-helix	trans	-75.6	-28.9	-171.9	-179.2	0	0	0	0	112.7	V1176 L1182 G1184	V1176-V1180 HydrophobicContact CG1-CG2 4.08Å; V1180-L1182 PolarHBondContact O-N 3.16Å; V1180-G1184 PolarHBondContact O-N 3.24Å
1181	G	38.9	Very low	42.8	Very low	60 Å²	60	119.6 Å²	119.6	62%	0.619	62%	0.623	S	S	*	*	H	α-helix	trans	-65.6	-37.7	-176.8	0	0	0	0	0	114.4
1182	L	39	Very low	45.5	Very low	138 Å²	138	117.8 Å²	117.8	72%	0.723	61%	0.609	S	S	*	*	H	α-helix	trans	-72.5	-43.3	-177.8	-95.1	139.9	0	0	0	112.4	V1180 G1184 S1185	V1180-L1182 PolarHBondContact O-N 3.16Å; L1182-G1184 PolarHBondContact O-N 3.5Å; L1182-S1185 PolarHBondContact O-N 3.35Å; L1182-S1185 PolarHBondContact O-OG 2.88Å
1183	L	36	Very low	48.2	Very low	128 Å²	128	116.1 Å²	116.1	67%	0.67	60%	0.603	S	S	*	*	H	α-helix	trans	-65.3	-37.6	179.9	-104.1	117.5	0	0	0	113.1	S1185 Q1186 V1187	L1183-S1185 PolarHBondContact O-N 2.99Å; L1183-Q1186 PolarHBondContact O-N 2.87Å; L1183-V1187 WeakPolarHBondContact O-CG2 3.3Å; L1183-V1187 PolarHBondContact O-N 3.15Å
1184	G	46	Very low	50.8	Low	41 Å²	41	115.5 Å²	115.5	42%	0.423	60%	0.596	S	S	.	*	H	α-helix	trans	-64.2	-27	-179.5	0	0	0	0	0	114.1	V1180 L1182	V1180-G1184 PolarHBondContact O-N 3.24Å; L1182-G1184 PolarHBondContact O-N 3.5Å
1185	S	51.5	Low	53.2	Low	58 Å²	58	113.1 Å²	113.1	41%	0.406	59%	0.589	S	S	.	*	H	α-helix	trans	-77.1	-34.3	178.6	73.9	0	0	0	0	113.2	L1182 L1183	L1182-S1185 PolarHBondContact O-N 3.35Å; L1182-S1185 PolarHBondContact O-OG 2.88Å; L1183-S1185 PolarHBondContact O-N 2.99Å
1186	Q	54.9	Low	55.9	Low	89 Å²	89	110.4 Å²	110.4	42%	0.416	58%	0.576	S	S	.	*	H	α-helix	trans	-72.2	-47.9	179.5	-170.1	68.8	25.6	0	0	111.1	L1183 K1188 R1189 D1190	L1183-Q1186 PolarHBondContact O-N 2.87Å; Q1186-K1188 VanDerWaalsContact C-N 3.25Å; Q1186-K1188 PolarHBondContact O-N 3.43Å; Q1186-R1189 VanDerWaalsContact NE2-NH1 3.16Å; Q1186-R1189 PolarHBondContact O-N 3.35Å; Q1186-D1190 PolarHBondContact O-N 3.03Å
1187	V	59.4	Low	58.5	Low	80 Å²	80	112.7 Å²	112.7	49%	0.485	58%	0.582	S	S	.	*	H	α-helix	trans	-61	-33.8	-179.4	175.8	0	0	0	0	112.2	L1183 M1191	L1183-V1187 WeakPolarHBondContact O-CG2 3.3Å; L1183-V1187 PolarHBondContact O-N 3.15Å; V1187-M1191 VanDerWaalsContact O-CB 3.31Å; V1187-M1191 WeakPolarHBondContact O-CB 3.49Å; V1187-M1191 PolarHBondContact O-N 2.8Å; V1187-M1191 VanDerWaalsContact O-N 3.09Å
1188	K	67	Low	60.5	Low	171 Å²	171	108.2 Å²	108.2	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-67.3	-32.1	175.9	-85.4	-177	176.1	179.3	0	113.3	Q1186	Q1186-K1188 VanDerWaalsContact C-N 3.25Å; Q1186-K1188 PolarHBondContact O-N 3.43Å
1189	R	67.5	Low	63.3	Low	125 Å²	125	105.4 Å²	105.4	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-71.7	-50.8	176.3	-100	-175.8	-76.7	101.1	-0.4	110.7	Q1186 M1191 K1192 E1193	Q1186-R1189 VanDerWaalsContact NE2-NH1 3.16Å; Q1186-R1189 PolarHBondContact O-N 3.35Å; R1189-M1191 VanDerWaalsContact C-N 3.29Å; R1189-M1191 PolarHBondContact O-N 2.94Å; R1189-K1192 WeakPolarHBondContact O-CB 3.5Å; R1189-K1192 PolarHBondContact O-N 3.42Å; R1189-E1193 PolarHBondContact O-N 3.27Å
1190	D	69.5	Low	66.1	Low	75 Å²	75	110 Å²	110	40%	0.401	56%	0.559	S	S	.	*	H	α-helix	trans	-61.9	-37.7	-178.1	-56	-6.5	0	0	0	111.5	Q1186 K1192 E1193 V1194	Q1186-D1190 PolarHBondContact O-N 3.03Å; D1190-K1192 VanDerWaalsContact C-N 3.27Å; D1190-K1192 PolarHBondContact O-N 2.93Å; D1190-E1193 PolarHBondContact O-N 3.44Å; D1190-V1194 WeakPolarHBondContact O-CG2 3.4Å; D1190-V1194 PolarHBondContact O-N 3.44Å
1191	M	65.3	Low	68.3	Low	120 Å²	120	109.3 Å²	109.3	59%	0.591	55%	0.551	S	S	*	*	H	α-helix	trans	-66.1	-27.7	176.4	-169.1	109.4	82.6	0	0	113.1	V1187 R1189 K1195	V1187-M1191 VanDerWaalsContact O-CB 3.31Å; V1187-M1191 WeakPolarHBondContact O-CB 3.49Å; V1187-M1191 PolarHBondContact O-N 2.8Å; V1187-M1191 VanDerWaalsContact O-N 3.09Å; R1189-M1191 VanDerWaalsContact C-N 3.29Å; R1189-M1191 PolarHBondContact O-N 2.94Å; M1191-K1195 WeakPolarHBondContact O-CG 3.45Å; M1191-K1195 PolarHBondContact O-N 2.99Å
1192	K	81.8	Confident	70.5	Confident	133 Å²	133	110.4 Å²	110.4	58%	0.578	54%	0.543	S	S	*	.	H	α-helix	trans	-73	-44.6	178	-169.4	-174.9	174.8	-164.4	0	110.8	R1189 D1190 V1194 K1195 E1196	R1189-K1192 WeakPolarHBondContact O-CB 3.5Å; R1189-K1192 PolarHBondContact O-N 3.42Å; D1190-K1192 VanDerWaalsContact C-N 3.27Å; D1190-K1192 PolarHBondContact O-N 2.93Å; K1192-V1194 PolarHBondContact O-N 2.87Å; K1192-K1195 PolarHBondContact O-N 2.92Å; K1192-E1196 WeakPolarHBondContact CE-OE1 3.43Å; K1192-E1196 IonicContact NZ-OE1 3.49Å; K1192-E1196 PolarHBondContact O-N 3.42Å
1193	E	80.5	Confident	72.9	Confident	128 Å²	128	109.8 Å²	109.8	60%	0.598	54%	0.536	S	S	*	.	H	α-helix	trans	-61.6	-44.7	179.6	-69.3	177.6	179.2	0	0	111.8	R1189 D1190 K1195 E1196 E1197	R1189-E1193 PolarHBondContact O-N 3.27Å; D1190-E1193 PolarHBondContact O-N 3.44Å; E1193-K1195 VanDerWaalsContact C-N 3.31Å; E1193-K1195 PolarHBondContact O-N 3.08Å; E1193-E1196 PolarHBondContact O-N 3.18Å; E1193-E1197 PolarHBondContact O-N 3.41Å; E1193-E1197 VanDerWaalsContact O-N 3.08Å
1194	V	80.6	Confident	75.4	Confident	84 Å²	84	108.6 Å²	108.6	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-34.4	178.8	174.3	0	0	0	0	112.6	D1190 K1192 N1198	D1190-V1194 WeakPolarHBondContact O-CG2 3.4Å; D1190-V1194 PolarHBondContact O-N 3.44Å; K1192-V1194 PolarHBondContact O-N 2.87Å; V1194-N1198 WeakPolarHBondContact O-CB 3.3Å; V1194-N1198 PolarHBondContact O-N 3.24Å; V1194-N1198 VanDerWaalsContact O-N 3.13Å; V1194-N1198 PolarHBondContact O-ND2 3.48Å
1195	K	83	Confident	77.1	Confident	150 Å²	150	110.6 Å²	110.6	65%	0.652	53%	0.531	S	S	*	.	H	α-helix	trans	-68.3	-40.3	176.6	-81.5	-175.9	176.4	-175.5	0	112	M1191 K1192 E1193 Q1199	M1191-K1195 WeakPolarHBondContact O-CG 3.45Å; M1191-K1195 PolarHBondContact O-N 2.99Å; K1192-K1195 PolarHBondContact O-N 2.92Å; E1193-K1195 VanDerWaalsContact C-N 3.31Å; E1193-K1195 PolarHBondContact O-N 3.08Å; K1195-Q1199 PolarHBondContact O-N 3.28Å
1196	E	86.1	Confident	78.8	Confident	116 Å²	116	113.5 Å²	113.5	54%	0.542	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-39.3	178.8	-69.9	174.4	-176.9	0	0	111.2	K1192 E1193 Q1199 R1200	K1192-E1196 WeakPolarHBondContact CE-OE1 3.43Å; K1192-E1196 IonicContact NZ-OE1 3.49Å; K1192-E1196 PolarHBondContact O-N 3.42Å; E1193-E1196 PolarHBondContact O-N 3.18Å; E1196-Q1199 PolarHBondContact O-N 2.95Å; E1196-R1200 PolarHBondContact O-N 3.38Å
1197	E	87	Confident	80.4	Confident	129 Å²	129	112.3 Å²	112.3	60%	0.603	54%	0.538	S	S	*	.	H	α-helix	trans	-68.9	-41.1	177.6	-170.8	158.2	-160.8	0	0	113.2	E1193 Q1199 R1200 L1201	E1193-E1197 PolarHBondContact O-N 3.41Å; E1193-E1197 VanDerWaalsContact O-N 3.08Å; E1197-Q1199 VanDerWaalsContact C-N 3.31Å; E1197-Q1199 PolarHBondContact O-N 3.46Å; E1197-R1200 WeakPolarHBondContact O-CB 3.29Å; E1197-R1200 PolarHBondContact O-N 2.69Å; E1197-L1201 PolarHBondContact O-N 3.24Å; E1197-L1201 VanDerWaalsContact O-N 3.09Å
1198	N	75.5	Confident	81.6	Confident	100 Å²	100	113.3 Å²	113.3	54%	0.535	54%	0.54	S	S	.	.	H	α-helix	trans	-62.8	-37.5	174.9	-80.8	-30.9	0	0	0	112.6	V1194 R1200 L1201 L1202	V1194-N1198 WeakPolarHBondContact O-CB 3.3Å; V1194-N1198 PolarHBondContact O-N 3.24Å; V1194-N1198 VanDerWaalsContact O-N 3.13Å; V1194-N1198 PolarHBondContact O-ND2 3.48Å; N1198-R1200 VanDerWaalsContact C-N 3.35Å; N1198-L1201 PolarHBondContact O-N 2.99Å; N1198-L1202 PolarHBondContact O-N 3.38Å; N1198-L1202 VanDerWaalsContact O-N 3.11Å
1199	Q	88.6	Confident	82.2	Confident	110 Å²	110	108.6 Å²	108.6	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-65.1	-40.3	176.2	-171.7	65.1	26.2	0	0	111.3	K1195 E1196 E1197 L1202 E1203	K1195-Q1199 PolarHBondContact O-N 3.28Å; E1196-Q1199 PolarHBondContact O-N 2.95Å; E1197-Q1199 VanDerWaalsContact C-N 3.31Å; E1197-Q1199 PolarHBondContact O-N 3.46Å; Q1199-L1202 PolarHBondContact O-N 2.73Å; Q1199-E1203 PolarHBondContact O-N 3.21Å
1200	R	92.1	Very high	82.9	Confident	177 Å²	177	108.9 Å²	108.9	67%	0.668	54%	0.535	S	S	*	.	H	α-helix	trans	-62.1	-45.2	176.8	-171.6	-176.5	179.2	-80.7	-3.4	112.1	E1196 E1197 N1198 L1202 E1203 E1204	E1196-R1200 PolarHBondContact O-N 3.38Å; E1197-R1200 WeakPolarHBondContact O-CB 3.29Å; E1197-R1200 PolarHBondContact O-N 2.69Å; N1198-R1200 VanDerWaalsContact C-N 3.35Å; R1200-L1202 VanDerWaalsContact C-N 3.34Å; R1200-L1202 PolarHBondContact O-N 2.71Å; R1200-E1203 PolarHBondContact O-N 3.23Å; R1200-E1204 PolarHBondContact O-N 3.04Å
1201	L	84.3	Confident	83.7	Confident	83 Å²	83	109.9 Å²	109.9	44%	0.435	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-35.2	179	-70.4	170.9	0	0	0	112.5	E1197 N1198 E1203 E1204 V1205	E1197-L1201 PolarHBondContact O-N 3.24Å; E1197-L1201 VanDerWaalsContact O-N 3.09Å; N1198-L1201 PolarHBondContact O-N 2.99Å; L1201-E1203 VanDerWaalsContact C-N 3.34Å; L1201-E1203 PolarHBondContact O-N 3.07Å; L1201-E1204 PolarHBondContact O-N 3.12Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.23Å; L1201-V1205 PolarHBondContact O-N 3.1Å; L1201-V1205 VanDerWaalsContact O-N 3.14Å
1202	L	86	Confident	84.1	Confident	83 Å²	83	108.3 Å²	108.3	44%	0.435	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-37.8	177.1	-175.4	65.2	0	0	0	112.3	N1198 Q1199 R1200 K1206	N1198-L1202 PolarHBondContact O-N 3.38Å; N1198-L1202 VanDerWaalsContact O-N 3.11Å; Q1199-L1202 PolarHBondContact O-N 2.73Å; R1200-L1202 VanDerWaalsContact C-N 3.34Å; R1200-L1202 PolarHBondContact O-N 2.71Å; L1202-K1206 WeakPolarHBondContact O-CG 3.41Å; L1202-K1206 PolarHBondContact O-N 3.24Å
1203	E	88.5	Confident	83.7	Confident	126 Å²	126	108.2 Å²	108.2	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-68	-36.3	175.7	-65.4	-136.6	165.2	0	0	112.4	Q1199 R1200 L1201 K1206 S1207	Q1199-E1203 PolarHBondContact O-N 3.21Å; R1200-E1203 PolarHBondContact O-N 3.23Å; L1201-E1203 VanDerWaalsContact C-N 3.34Å; L1201-E1203 PolarHBondContact O-N 3.07Å; E1203-K1206 PolarHBondContact O-N 3.4Å; E1203-S1207 PolarHBondContact O-N 3.05Å; E1203-S1207 VanDerWaalsContact O-N 3.08Å
1204	E	87.7	Confident	83.8	Confident	102 Å²	102	106.2 Å²	106.2	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-65.4	-40.3	177.4	-166.3	168.6	-174	0	0	112.3	R1200 L1201 S1207 L1208	R1200-E1204 PolarHBondContact O-N 3.04Å; L1201-E1204 PolarHBondContact O-N 3.12Å; E1204-S1207 WeakPolarHBondContact O-CB 3.25Å; E1204-S1207 PolarHBondContact O-N 3.39Å; E1204-L1208 PolarHBondContact O-N 3.27Å; E1204-L1208 VanDerWaalsContact O-N 3.1Å
1205	V	82.4	Confident	83.7	Confident	84 Å²	84	106 Å²	106	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-41	175.3	173.6	0	0	0	0	111.8	L1201 S1207 L1208 C1209	L1201-V1205 WeakPolarHBondContact O-CG2 3.23Å; L1201-V1205 PolarHBondContact O-N 3.1Å; L1201-V1205 VanDerWaalsContact O-N 3.14Å; V1205-S1207 VanDerWaalsContact C-N 3.34Å; V1205-S1207 PolarHBondContact O-N 3.25Å; V1205-L1208 PolarHBondContact O-N 2.99Å; V1205-C1209 PolarHBondContact O-N 3.23Å
1206	K	87.3	Confident	83	Confident	119 Å²	119	108.3 Å²	108.3	52%	0.517	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-43.1	176.9	-73.9	176.7	-179.9	178	0	111.6	L1202 E1203 L1208 C1209 Q1210	L1202-K1206 WeakPolarHBondContact O-CG 3.41Å; L1202-K1206 PolarHBondContact O-N 3.24Å; E1203-K1206 PolarHBondContact O-N 3.4Å; K1206-L1208 PolarHBondContact O-N 3.36Å; K1206-C1209 PolarHBondContact O-N 3.13Å; K1206-Q1210 PolarHBondContact O-N 3.03Å; K1206-Q1210 VanDerWaalsContact O-N 3.13Å
1207	S	87.9	Confident	82.4	Confident	64 Å²	64	106 Å²	106	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-56.1	-48	173.6	156.4	0	0	0	0	112.2	E1203 E1204 V1205 C1209 Q1210 I1211	E1203-S1207 PolarHBondContact O-N 3.05Å; E1203-S1207 VanDerWaalsContact O-N 3.08Å; E1204-S1207 WeakPolarHBondContact O-CB 3.25Å; E1204-S1207 PolarHBondContact O-N 3.39Å; V1205-S1207 VanDerWaalsContact C-N 3.34Å; V1205-S1207 PolarHBondContact O-N 3.25Å; S1207-C1209 PolarHBondContact O-N 3.24Å; S1207-Q1210 PolarHBondContact O-N 2.83Å; S1207-I1211 WeakPolarHBondContact O-CG1 3.11Å; S1207-I1211 PolarHBondContact O-N 2.88Å; S1207-I1211 VanDerWaalsContact O-N 3.11Å
1208	L	84.6	Confident	81.9	Confident	100 Å²	100	106.7 Å²	106.7	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-41.5	179.4	-77	166.8	0	0	0	113	E1204 V1205 K1206 Q1210 I1211 C1212	E1204-L1208 PolarHBondContact O-N 3.27Å; E1204-L1208 VanDerWaalsContact O-N 3.1Å; V1205-L1208 PolarHBondContact O-N 2.99Å; K1206-L1208 PolarHBondContact O-N 3.36Å; L1208-Q1210 VanDerWaalsContact C-N 3.32Å; L1208-Q1210 PolarHBondContact O-N 3.24Å; L1208-I1211 PolarHBondContact O-N 3.13Å; L1208-C1212 PolarHBondContact O-N 2.94Å; L1208-C1212 PolarHBondContact O-SG 3.37Å
1209	C	79.6	Confident	81.5	Confident	73 Å²	73	106.4 Å²	106.4	49%	0.493	53%	0.533	S	S	.	.	H	α-helix	trans	-60.1	-42.6	175.4	-77.1	0	0	0	0	111.9	V1205 K1206 S1207 I1211 C1212 E1213	V1205-C1209 PolarHBondContact O-N 3.23Å; K1206-C1209 PolarHBondContact O-N 3.13Å; S1207-C1209 PolarHBondContact O-N 3.24Å; C1209-I1211 VanDerWaalsContact C-N 3.34Å; C1209-I1211 PolarHBondContact O-N 3.4Å; C1209-C1212 PolarHBondContact O-N 2.8Å; C1209-E1213 PolarHBondContact O-N 3.45Å
1210	Q	83.3	Confident	80.1	Confident	131 Å²	131	103.8 Å²	103.8	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-63.2	-40.9	179	-148.8	117.3	24.1	0	0	111.6	K1206 S1207 L1208 C1212 E1213 D1214	K1206-Q1210 PolarHBondContact O-N 3.03Å; K1206-Q1210 VanDerWaalsContact O-N 3.13Å; S1207-Q1210 PolarHBondContact O-N 2.83Å; L1208-Q1210 VanDerWaalsContact C-N 3.32Å; L1208-Q1210 PolarHBondContact O-N 3.24Å; Q1210-C1212 PolarHBondContact O-N 3.14Å; Q1210-E1213 PolarHBondContact O-N 3.15Å; Q1210-D1214 PolarHBondContact O-N 2.95Å
1211	I	85	Confident	78.3	Confident	95 Å²	95	99.1 Å²	99.1	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-42.2	175.2	-65.9	166.8	0	0	0	111	S1207 L1208 C1209 E1213 D1214 V1215	S1207-I1211 WeakPolarHBondContact O-CG1 3.11Å; S1207-I1211 PolarHBondContact O-N 2.88Å; S1207-I1211 VanDerWaalsContact O-N 3.11Å; L1208-I1211 PolarHBondContact O-N 3.13Å; C1209-I1211 VanDerWaalsContact C-N 3.34Å; C1209-I1211 PolarHBondContact O-N 3.4Å; I1211-E1213 PolarHBondContact O-N 3.41Å; I1211-D1214 PolarHBondContact O-N 2.84Å; I1211-V1215 WeakPolarHBondContact O-CG2 3.5Å; I1211-V1215 PolarHBondContact O-N 3.2Å
1212	C	73.5	Confident	77.2	Confident	87 Å²	87	102.2 Å²	102.2	59%	0.588	53%	0.532	S	S	*	.	H	α-helix	trans	-63.5	-39.9	177.5	-72.4	0	0	0	0	112.6	L1208 C1209 Q1210 V1215 R1216	L1208-C1212 PolarHBondContact O-N 2.94Å; L1208-C1212 PolarHBondContact O-SG 3.37Å; C1209-C1212 PolarHBondContact O-N 2.8Å; Q1210-C1212 PolarHBondContact O-N 3.14Å; C1212-V1215 PolarHBondContact O-N 3.47Å; C1212-R1216 WeakPolarHBondContact O-CB 3.37Å; C1212-R1216 PolarHBondContact O-N 2.81Å
1213	E	75.2	Confident	75.4	Confident	132 Å²	132	102 Å²	102	62%	0.617	54%	0.537	S	S	*	.	H	α-helix	trans	-65.8	-40.9	175.6	-73	-175.1	164.8	0	0	112	C1209 Q1210 I1211 R1216 S1217	C1209-E1213 PolarHBondContact O-N 3.45Å; Q1210-E1213 PolarHBondContact O-N 3.15Å; I1211-E1213 PolarHBondContact O-N 3.41Å; E1213-R1216 WeakPolarHBondContact O-CB 3.1Å; E1213-R1216 PolarHBondContact O-N 3.3Å; E1213-S1217 PolarHBondContact O-N 3.04Å
1214	D	82	Confident	73.4	Confident	86 Å²	86	105 Å²	105	46%	0.46	54%	0.543	S	S	.	.	H	α-helix	trans	-63.2	-41.2	176	-105.2	17.5	0	0	0	112.9	Q1210 I1211 R1216 S1217 K1218	Q1210-D1214 PolarHBondContact O-N 2.95Å; I1211-D1214 PolarHBondContact O-N 2.84Å; D1214-R1216 VanDerWaalsContact C-N 3.32Å; D1214-S1217 PolarHBondContact O-N 3.23Å; D1214-S1217 PolarHBondContact O-OG 3.3Å; D1214-K1218 VanDerWaalsContact O-CG 3.31Å; D1214-K1218 WeakPolarHBondContact O-CG 3.28Å; D1214-K1218 PolarHBondContact O-N 2.82Å; D1214-K1218 VanDerWaalsContact O-N 3.12Å
1215	V	77.5	Confident	71.7	Confident	78 Å²	78	103.2 Å²	103.2	47%	0.473	54%	0.542	S	S	.	.	H	α-helix	trans	-64.1	-41.7	174.9	170.3	0	0	0	0	110.2	I1211 C1212 K1218 L1219	I1211-V1215 WeakPolarHBondContact O-CG2 3.5Å; I1211-V1215 PolarHBondContact O-N 3.2Å; C1212-V1215 PolarHBondContact O-N 3.47Å; V1215-K1218 PolarHBondContact O-N 3.29Å; V1215-L1219 HydrophobicContact CG1-CD1 3.69Å; V1215-L1219 PolarHBondContact O-N 3.08Å; V1215-L1219 VanDerWaalsContact O-N 3.08Å
1216	R	68.6	Low	69.9	Low	199 Å²	199	105 Å²	105	75%	0.751	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-40.8	178.8	-159.5	179.2	-159.2	179.2	5.9	112	C1212 E1213 D1214 K1218 L1219 A1220	C1212-R1216 WeakPolarHBondContact O-CB 3.37Å; C1212-R1216 PolarHBondContact O-N 2.81Å; E1213-R1216 WeakPolarHBondContact O-CB 3.1Å; E1213-R1216 PolarHBondContact O-N 3.3Å; D1214-R1216 VanDerWaalsContact C-N 3.32Å; R1216-K1218 VanDerWaalsContact C-N 3.33Å; R1216-K1218 PolarHBondContact O-N 2.99Å; R1216-L1219 PolarHBondContact O-N 3.46Å; R1216-A1220 WeakPolarHBondContact O-CB 3.28Å; R1216-A1220 PolarHBondContact O-N 3.36Å; R1216-A1220 VanDerWaalsContact O-N 3.1Å
1217	S	73.3	Confident	67.7	Low	69 Å²	69	107.5 Å²	107.5	48%	0.483	56%	0.559	S	S	.	*	H	α-helix	trans	-66.6	-34.7	178.5	81.3	0	0	0	0	112	E1213 D1214 P1221	E1213-S1217 PolarHBondContact O-N 3.04Å; D1214-S1217 PolarHBondContact O-N 3.23Å; D1214-S1217 PolarHBondContact O-OG 3.3Å; S1217-P1221 WeakPolarHBondContact O-CD 3.34Å
1218	K	76.3	Confident	65.4	Low	143 Å²	143	109.4 Å²	109.4	62%	0.622	56%	0.564	S	S	*	*	H	α-helix	trans	-74.3	-33.1	176.3	-71.3	170.9	-174.2	167.2	0	113.5	D1214 V1215 R1216	D1214-K1218 VanDerWaalsContact O-CG 3.31Å; D1214-K1218 WeakPolarHBondContact O-CG 3.28Å; D1214-K1218 PolarHBondContact O-N 2.82Å; D1214-K1218 VanDerWaalsContact O-N 3.12Å; V1215-K1218 PolarHBondContact O-N 3.29Å; R1216-K1218 VanDerWaalsContact C-N 3.33Å; R1216-K1218 PolarHBondContact O-N 2.99Å
1219	L	68.8	Low	63.1	Low	94 Å²	94	113.8 Å²	113.8	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-80.8	-34.4	-179.3	-89.1	152.1	0	0	0	113.8	V1215 R1216 K1222 C1223	V1215-L1219 HydrophobicContact CG1-CD1 3.69Å; V1215-L1219 PolarHBondContact O-N 3.08Å; V1215-L1219 VanDerWaalsContact O-N 3.08Å; R1216-L1219 PolarHBondContact O-N 3.46Å; L1219-K1222 PolarHBondContact O-N 2.81Å; L1219-C1223 PolarHBondContact O-N 2.97Å; L1219-C1223 PolarHBondContact O-SG 3.31Å; L1219-C1223 VanDerWaalsContact O-SG 3.38Å
1220	A	58.8	Low	61.1	Low	55 Å²	55	121.4 Å²	121.4	46%	0.455	59%	0.592	S	S	.	*	H	α-helix	trans	-55.7	-47.9	-177.5	0	0	0	0	0	114.4	R1216 R1224	R1216-A1220 WeakPolarHBondContact O-CB 3.28Å; R1216-A1220 PolarHBondContact O-N 3.36Å; R1216-A1220 VanDerWaalsContact O-N 3.1Å; A1220-R1224 WeakPolarHBondContact O-CB 3.29Å; A1220-R1224 PolarHBondContact O-N 3.45Å
1221	P	53.6	Low	58.6	Low	78 Å²	78	126.2 Å²	126.2	51%	0.506	60%	0.604	S	S	.	*	H	α-helix	trans	-72.1	-29.1	177.6	25.1	-31	0	0	0	112.7	S1217 R1224 S1225	S1217-P1221 WeakPolarHBondContact O-CD 3.34Å; P1221-R1224 PolarHBondContact O-N 3.4Å; P1221-S1225 WeakPolarHBondContact O-CB 3.34Å; P1221-S1225 PolarHBondContact O-N 3.4Å
1222	K	62	Low	56.2	Low	148 Å²	148	126.4 Å²	126.4	64%	0.643	61%	0.614	S	S	*	*	H	α-helix	trans	-69.1	-38.2	178.1	-141	168.8	-172.8	177.3	0	111.9	L1219 S1225 L1226	L1219-K1222 PolarHBondContact O-N 2.81Å; K1222-S1225 PolarHBondContact O-OG 3.08Å; K1222-L1226 WeakPolarHBondContact O-CG 3.36Å; K1222-L1226 PolarHBondContact O-N 2.64Å
1223	C	48.6	Very low	54.1	Low	79 Å²	79	126.7 Å²	126.7	53%	0.534	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-37.9	172	-64.2	0	0	0	0	111.6	L1219 F1227	L1219-C1223 PolarHBondContact O-N 2.97Å; L1219-C1223 PolarHBondContact O-SG 3.31Å; L1219-C1223 VanDerWaalsContact O-SG 3.38Å; C1223-F1227 PolarHBondContact O-N 3.37Å
1224	R	46.1	Very low	52.2	Low	188 Å²	188	126 Å²	126	71%	0.709	63%	0.627	S	S	*	*	H	α-helix	trans	-71.4	-34.9	-179.7	-151.1	178.2	-85	-170.5	-5	112	A1220 P1221 F1227 L1228	A1220-R1224 WeakPolarHBondContact O-CB 3.29Å; A1220-R1224 PolarHBondContact O-N 3.45Å; P1221-R1224 PolarHBondContact O-N 3.4Å; R1224-F1227 PolarHBondContact O-N 2.95Å; R1224-L1228 HydrophobicContact CG-CD1 4.45Å; R1224-L1228 WeakPolarHBondContact O-CD1 3.31Å; R1224-L1228 PolarHBondContact O-N 3.39Å; R1224-L1228 VanDerWaalsContact O-N 3.12Å
1225	S	50.4	Low	49.5	Very low	65 Å²	65	125.5 Å²	125.5	46%	0.455	64%	0.642	S	S	.	*	H	α-helix	trans	-71	-38	176	80.7	0	0	0	0	112.7	P1221 K1222 F1227 L1228 R1229	P1221-S1225 WeakPolarHBondContact O-CB 3.34Å; P1221-S1225 PolarHBondContact O-N 3.4Å; K1222-S1225 PolarHBondContact O-OG 3.08Å; S1225-F1227 VanDerWaalsContact C-N 3.29Å; S1225-F1227 PolarHBondContact O-N 3.45Å; S1225-L1228 PolarHBondContact O-N 3.04Å; S1225-R1229 WeakPolarHBondContact O-CB 3.27Å; S1225-R1229 PolarHBondContact O-N 2.99Å
1226	L	46	Very low	47.2	Very low	122 Å²	122	128.5 Å²	128.5	64%	0.639	66%	0.66	S	S	*	*	H	α-helix	trans	-62.7	-36.6	173.7	-78	168.1	0	0	0	112.1	K1222	K1222-L1226 WeakPolarHBondContact O-CG 3.36Å; K1222-L1226 PolarHBondContact O-N 2.64Å
1227	F	41.3	Very low	45.4	Very low	171 Å²	171	124.2 Å²	124.2	75%	0.75	66%	0.658	S	S	*	*	H	α-helix	trans	-71.6	-38.5	177.9	-163	-96.5	0	0	0	112.7	C1223 R1224 S1225	C1223-F1227 PolarHBondContact O-N 3.37Å; R1224-F1227 PolarHBondContact O-N 2.95Å; S1225-F1227 VanDerWaalsContact C-N 3.29Å; S1225-F1227 PolarHBondContact O-N 3.45Å
1228	L	40.1	Very low	43	Very low	104 Å²	104	125.8 Å²	125.8	55%	0.545	67%	0.669	S	S	.	*	H	α-helix	trans	-74.5	-33.4	178.1	-78.5	156.7	0	0	0	112.8	R1224 S1225 R1230 R1231 S1232	R1224-L1228 HydrophobicContact CG-CD1 4.45Å; R1224-L1228 WeakPolarHBondContact O-CD1 3.31Å; R1224-L1228 PolarHBondContact O-N 3.39Å; R1224-L1228 VanDerWaalsContact O-N 3.12Å; S1225-L1228 PolarHBondContact O-N 3.04Å; L1228-R1230 PolarHBondContact O-N 2.89Å; L1228-R1231 PolarHBondContact O-N 3.24Å; L1228-S1232 PolarHBondContact O-OG 3.05Å
1229	R	35.9	Very low	40.7	Very low	193 Å²	193	124.9 Å²	124.9	73%	0.728	68%	0.678	S	S	*	*	H	α-helix	trans	-62.9	-30.1	179	-128.9	177.1	-179.3	-178.3	-1.1	113.1	S1225 R1231 S1233	S1225-R1229 WeakPolarHBondContact O-CB 3.27Å; S1225-R1229 PolarHBondContact O-N 2.99Å; R1229-R1231 PolarHBondContact O-N 3.41Å; R1229-S1233 PolarHBondContact O-OG 2.86Å
1230	R	37.6	Very low	38.5	Very low	232 Å²	232	127.9 Å²	127.9	88%	0.875	69%	0.689	S	S	*	*	H	α-helix	trans	-68	-16.9	175.3	-102.8	-176	177.8	-179.6	-0.3	114	L1228	L1228-R1230 PolarHBondContact O-N 2.89Å
1231	R	30.3	Very low	36.8	Very low	232 Å²	232	132.2 Å²	132.2	88%	0.875	71%	0.705	S	S	*	*	H	α-helix	trans	-101.7	-10.9	-177.9	-141.9	177.6	-179.7	-175.1	-1.5	114	L1228 R1229	L1228-R1231 PolarHBondContact O-N 3.24Å; R1229-R1231 PolarHBondContact O-N 3.41Å
1232	S	35.1	Very low	35.4	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	72%	0.723	S	S	*	*	H	α-helix	trans	-119.9	4.9	-172.8	-34.1	0	0	0	0	114.6	L1228	L1228-S1232 PolarHBondContact O-OG 3.05Å
1233	S	29	Very low	33.7	Very low	92 Å²	92	133 Å²	133	64%	0.643	73%	0.726	S	S	*	*			trans	-117.1	60	-178.6	51.8	0	0	0	0	112.2	R1229	R1229-S1233 PolarHBondContact O-OG 2.86Å
1234	S	34	Very low	32.5	Very low	119 Å²	119	137 Å²	137	83%	0.832	74%	0.743	S	S	*	*			trans	-137.2	59.9	155.6	63.9	0	0	0	0	108.4
1235	G	25.7	Very low	31.6	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	75%	0.75	S	S	*	*			trans	-115	104.9	163.1	0	0	0	0	0	107.3
1236	V	29	Very low	30.5	Very low	140 Å²	140	137.4 Å²	137.4	85%	0.848	76%	0.763	S	S	*	*			trans	-131.6	139.6	169	174.9	0	0	0	0	106
1237	P	31.6	Very low	29.5	Very low	109 Å²	109	136.4 Å²	136.4	71%	0.708	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-97.8	162.1	-132.5	37.4	-36.3	0	0	0	114.3	P1239	P1237-P1239 WeakPolarHBondContact O-CD 3.45Å
1238	S	23.3	Very low	28.8	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-52.7	125.4	173.1	55.6	0	0	0	0	113
1239	P	27.3	Very low	28.3	Very low	124 Å²	124	135.9 Å²	135.9	81%	0.805	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-88.8	123.2	153.4	9.3	10.3	0	0	0	108.9	P1237	P1237-P1239 WeakPolarHBondContact O-CD 3.45Å
1240	H	23.1	Very low	28.1	Very low	158 Å²	158	132.2 Å²	132.2	73%	0.731	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-54.1	161	160.9	-85.3	-95.2	0	0	0	112.4
1241	D	23.1	Very low	27.9	Very low	146 Å²	146	124.6 Å²	124.6	78%	0.781	77%	0.773	S	S	*	*			trans	83.7	95.7	156.6	-55.4	-28.2	0	0	0	117.9
1242	C	23.6	Very low	28.4	Very low	131 Å²	131	118.7 Å²	118.7	89%	0.885	77%	0.765	S	S	*	*				-151	147.4	123.2	-95.3	0	0	0	0	110.7
1243	P	26.5	Very low	28.8	Very low	110 Å²	110	121.5 Å²	121.5	71%	0.714	77%	0.767	S	S	*	*			trans	-96.7	149.2	-146.5	35.9	-33	0	0	0	114.5	V1245	P1243-V1245 PolarHBondContact O-N 2.85Å
1244	N	22.5	Very low	29.6	Very low	165 Å²	165	123.5 Å²	123.5	88%	0.882	77%	0.766	S	S	*	*			trans	15.7	96.2	147.3	-67.9	-15.6	0	0	0	116.8
1245	V	27.6	Very low	30.5	Very low	142 Å²	142	121.4 Å²	121.4	86%	0.861	75%	0.748	S	S	*	*			trans	-110.3	118.7	145.4	179.9	0	0	0	0	107.2	P1243	P1243-V1245 PolarHBondContact O-N 2.85Å
1246	T	26.9	Very low	32.7	Very low	118 Å²	118	123.9 Å²	123.9	72%	0.724	74%	0.743	S	S	*	*			trans	-56	133.6	-177.8	39.7	0	0	0	0	111.9	D1248	T1246-D1248 PolarHBondContact O-N 3.39Å; T1246-D1248 VanDerWaalsContact O-N 3.11Å
1247	A	26.9	Very low	35	Very low	102 Å²	102	120.6 Å²	120.6	84%	0.843	72%	0.724	S	S	*	*			trans	-65.5	100	172.7	0	0	0	0	0	110.6
1248	D	25.5	Very low	37.5	Very low	148 Å²	148	115.6 Å²	115.6	79%	0.791	69%	0.691	S	S	*	*			trans	-107.5	114	158.6	-90.6	-21.1	0	0	0	109.2	T1246 S1250	T1246-D1248 PolarHBondContact O-N 3.39Å; T1246-D1248 VanDerWaalsContact O-N 3.11Å; D1248-S1250 PolarHBondContact O-N 3.42Å
1249	S	29.5	Very low	40.4	Very low	115 Å²	115	111.3 Å²	111.3	80%	0.804	66%	0.661	S	S	*	*			trans	-1.4	102.6	160.1	58.6	0	0	0	0	118
1250	S	31.7	Very low	43.1	Very low	117 Å²	117	112 Å²	112	82%	0.818	65%	0.651	S	S	*	*			trans	-89.3	112.2	158.2	59	0	0	0	0	109.6	D1248	D1248-S1250 PolarHBondContact O-N 3.42Å
1251	S	33	Very low	46	Very low	72 Å²	72	106 Å²	106	50%	0.503	62%	0.622	S	S	.	*			trans	-61.6	145.9	174.2	47	0	0	0	0	112.2	E1253	S1251-E1253 PolarHBondContact O-N 2.87Å; S1251-E1253 VanDerWaalsContact O-N 3.09Å
1252	P	41.5	Very low	49.1	Very low	107 Å²	107	99.1 Å²	99.1	70%	0.695	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	5.9	-172.3	28	-34.3	0	0	0	115.8
1253	E	42.6	Very low	52.1	Low	159 Å²	159	99.3 Å²	99.3	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-77.7	-22.6	-177.9	-72.7	-172.4	156.3	0	0	113.8	S1251	S1251-E1253 PolarHBondContact O-N 2.87Å; S1251-E1253 VanDerWaalsContact O-N 3.09Å
1254	H	46.2	Very low	54.8	Low	135 Å²	135	100.4 Å²	100.4	63%	0.625	56%	0.563	S	S	*	*	H	α-helix	trans	-83.4	-30.4	-175.1	-74.8	-44.2	0	0	0	114.6	T1257	H1254-T1257 PolarHBondContact O-OG1 2.81Å
1255	T	53.1	Low	57.6	Low	75 Å²	75	94.1 Å²	94.1	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-71.9	-28.4	-178.6	26	0	0	0	0	113.6	T1257 V1259	T1255-T1257 PolarHBondContact O-N 3.32Å; T1255-V1259 WeakPolarHBondContact O-CG2 3.39Å; T1255-V1259 PolarHBondContact O-N 3.28Å
1256	D	71.3	Confident	60.1	Low	126 Å²	126	93.9 Å²	93.9	67%	0.674	52%	0.523	S	S	*	.	H	α-helix	trans	-68.7	-32.6	179.8	-102.4	-7.8	0	0	0	113.1	K1260	D1256-K1260 WeakPolarHBondContact O-CB 3.42Å; D1256-K1260 PolarHBondContact O-N 3.4Å; D1256-K1260 VanDerWaalsContact O-N 3.15Å
1257	T	78.9	Confident	62.9	Low	72 Å²	72	88.8 Å²	88.8	44%	0.442	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-39.1	179.5	58.8	0	0	0	0	112.9	H1254 T1255 W1261	H1254-T1257 PolarHBondContact O-OG1 2.81Å; T1255-T1257 PolarHBondContact O-N 3.32Å; T1257-W1261 PolarHBondContact O-N 3.39Å; T1257-W1261 VanDerWaalsContact O-N 3.16Å
1258	L	82.9	Confident	65.4	Low	3 Å²	3	86.3 Å²	86.3	2%	0.016	46%	0.464	C	S	.	.	H	α-helix	trans	-64.6	-48.8	176.8	173.2	61.5	0	0	0	111.5	K1260 W1261 L1262 Y1280 L1282 L1285	L1258-K1260 VanDerWaalsContact C-N 3.3Å; L1258-K1260 PolarHBondContact O-N 2.84Å; L1258-W1261 HydrophobicContact CD1-CE3 4.43Å; L1258-W1261 PolarHBondContact O-N 2.8Å; L1258-L1262 HydrophobicContact CD1-CD1 3.77Å; L1258-L1262 HydrophobicContact CD1-CD2 4.31Å; L1258-L1262 HydrophobicContact CD1-CG 3.82Å; L1258-L1262 HydrophobicContact CD2-CD1 4.41Å; L1258-L1262 HydrophobicContact CG-CD1 3.85Å; L1258-L1262 HydrophobicContact CG-CG 4.29Å; L1258-L1262 WeakPolarHBondContact O-CG 3.48Å; L1258-L1262 PolarHBondContact O-N 2.79Å; L1258-Y1280 WeakPolarHBondContact CD2-O 3.2Å; L1258-L1282 HydrophobicContact CB-CB 4.18Å; L1258-L1282 HydrophobicContact CD1-CB 4.3Å; L1258-L1282 HydrophobicContact CD1-CD1 4.14Å; L1258-L1285 HydrophobicContact CD1-CD1 3.51Å
1259	V	84.7	Confident	68	Low	13 Å²	13	83.4 Å²	83.4	8%	0.079	45%	0.445	C	S	.	.	H	α-helix	trans	-62.2	-41.4	-176.8	178.8	0	0	0	0	110.9	T1255 L1262 R1263 I1272 K1276	T1255-V1259 WeakPolarHBondContact O-CG2 3.39Å; T1255-V1259 PolarHBondContact O-N 3.28Å; V1259-L1262 PolarHBondContact O-N 2.97Å; V1259-R1263 WeakPolarHBondContact O-CB 3.36Å; V1259-R1263 WeakPolarHBondContact O-CG 3.3Å; V1259-R1263 PolarHBondContact O-N 3.35Å; V1259-I1272 HydrophobicContact CG1-CG2 4.39Å; V1259-I1272 HydrophobicContact CG2-CG2 4.38Å; V1259-K1276 HydrophobicContact CG2-CD 4.42Å
1260	K	84.6	Confident	70.2	Confident	138 Å²	138	82.8 Å²	82.8	60%	0.6	43%	0.43	S	S	*	.	H	α-helix	trans	-60.8	-46.5	175.8	-171.3	-179.9	177.1	-175.3	0	111.5	D1256 L1258 R1263 E1264	D1256-K1260 WeakPolarHBondContact O-CB 3.42Å; D1256-K1260 PolarHBondContact O-N 3.4Å; D1256-K1260 VanDerWaalsContact O-N 3.15Å; L1258-K1260 VanDerWaalsContact C-N 3.3Å; L1258-K1260 PolarHBondContact O-N 2.84Å; K1260-R1263 PolarHBondContact O-N 2.85Å; K1260-E1264 WeakPolarHBondContact CE-OE1 3.42Å; K1260-E1264 WeakPolarHBondContact O-CG 3.24Å; K1260-E1264 PolarHBondContact O-N 3.38Å
1261	W	84.4	Confident	72.6	Confident	32 Å²	32	77.4 Å²	77.4	12%	0.121	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-44.4	178.3	-174.9	69	0	0	0	112.5	T1257 L1258 R1263 E1264 L1265 L1282 L1286 L1308 H1311 I1312	T1257-W1261 PolarHBondContact O-N 3.39Å; T1257-W1261 VanDerWaalsContact O-N 3.16Å; L1258-W1261 HydrophobicContact CD1-CE3 4.43Å; L1258-W1261 PolarHBondContact O-N 2.8Å; W1261-R1263 VanDerWaalsContact C-N 3.34Å; W1261-R1263 PolarHBondContact O-N 3.24Å; W1261-E1264 PolarHBondContact O-N 2.95Å; W1261-L1265 HydrophobicContact CD2-CD1 3.88Å; W1261-L1265 HydrophobicContact CE3-CD1 3.98Å; W1261-L1265 HydrophobicContact CH2-CD1 3.66Å; W1261-L1265 HydrophobicContact CZ2-CD1 3.52Å; W1261-L1265 HydrophobicContact CZ3-CD1 3.88Å; W1261-L1265 WeakPolarHBondContact O-CG 3.22Å; W1261-L1265 PolarHBondContact O-N 3.36Å; W1261-L1265 VanDerWaalsContact O-N 3.1Å; W1261-L1282 HydrophobicContact CB-CD1 4.18Å; W1261-L1282 HydrophobicContact CB-CD2 4.49Å; W1261-L1282 HydrophobicContact CD2-CD1 3.56Å; W1261-L1282 HydrophobicContact CE3-CD1 3.39Å; W1261-L1282 HydrophobicContact CG-CD1 3.93Å; W1261-L1282 HydrophobicContact CZ3-CD1 3.95Å; W1261-L1286 HydrophobicContact CH2-CD2 4.44Å; W1261-L1308 HydrophobicContact CH2-CD1 4.08Å; W1261-L1308 HydrophobicContact CZ3-CD1 3.73Å; W1261-H1311 HydrophobicContact CH2-CB 4.2Å; W1261-H1311 HydrophobicContact CZ2-CB 4.04Å; W1261-I1312 HydrophobicContact CH2-CG1 4.34Å
1262	L	87.9	Confident	75	Confident	1 Å²	1	74 Å²	74	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-64.7	-36.8	178.5	-66.4	174.6	0	0	0	112.5	L1258 V1259 L1265 N1266 I1267 I1272 L1275 L1285 L1308	L1258-L1262 HydrophobicContact CD1-CD1 3.77Å; L1258-L1262 HydrophobicContact CD1-CD2 4.31Å; L1258-L1262 HydrophobicContact CD1-CG 3.82Å; L1258-L1262 HydrophobicContact CD2-CD1 4.41Å; L1258-L1262 HydrophobicContact CG-CD1 3.85Å; L1258-L1262 HydrophobicContact CG-CG 4.29Å; L1258-L1262 WeakPolarHBondContact O-CG 3.48Å; L1258-L1262 PolarHBondContact O-N 2.79Å; V1259-L1262 PolarHBondContact O-N 2.97Å; L1262-L1265 PolarHBondContact O-N 2.86Å; L1262-N1266 PolarHBondContact O-N 3.43Å; L1262-I1267 HydrophobicContact CD2-CD1 3.63Å; L1262-I1267 PolarHBondContact O-N 3.45Å; L1262-I1272 HydrophobicContact CB-CD1 4.11Å; L1262-I1272 HydrophobicContact CB-CG1 3.95Å; L1262-I1272 HydrophobicContact CD1-CG1 4.01Å; L1262-I1272 HydrophobicContact CD1-CG2 4.47Å; L1262-L1275 HydrophobicContact CD1-CD1 3.77Å; L1262-L1275 HydrophobicContact CD2-CD1 4.29Å; L1262-L1285 HydrophobicContact CD2-CD1 4.47Å; L1262-L1308 HydrophobicContact CD2-CD1 3.76Å
1263	R	86.8	Confident	76.7	Confident	135 Å²	135	73 Å²	73	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-68.9	-38.4	174.4	-75.8	-178.3	174.8	160	3	112.5	V1259 K1260 W1261 L1265 N1266 E1269 I1272	V1259-R1263 WeakPolarHBondContact O-CB 3.36Å; V1259-R1263 WeakPolarHBondContact O-CG 3.3Å; V1259-R1263 PolarHBondContact O-N 3.35Å; K1260-R1263 PolarHBondContact O-N 2.85Å; W1261-R1263 VanDerWaalsContact C-N 3.34Å; W1261-R1263 PolarHBondContact O-N 3.24Å; R1263-L1265 PolarHBondContact O-N 3.24Å; R1263-N1266 PolarHBondContact O-N 2.91Å; R1263-N1266 VanDerWaalsContact O-N 3.09Å; R1263-E1269 IonicContact CZ-OE1 2.7Å; R1263-E1269 VanDerWaalsContact CZ-OE1 3.3Å; R1263-E1269 IonicContact NE-OE1 3.91Å; R1263-E1269 PolarHBondContact NE-OE1 3.46Å; R1263-E1269 IonicContact NH2-OE1 2.65Å; R1263-E1269 PolarHBondContact NH2-OE1 3Å; R1263-E1269 IonicContact NH2-OE2 3Å; R1263-E1269 PolarHBondContact NH2-OE2 3.44Å; R1263-I1272 HydrophobicContact CG-CD1 3.89Å
1264	E	81.8	Confident	78.4	Confident	134 Å²	134	67.6 Å²	67.6	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-61.5	-28.9	172	-75	173.2	-173.3	0	0	112.1	K1260 W1261 N1266	K1260-E1264 WeakPolarHBondContact CE-OE1 3.42Å; K1260-E1264 WeakPolarHBondContact O-CG 3.24Å; K1260-E1264 PolarHBondContact O-N 3.38Å; W1261-E1264 PolarHBondContact O-N 2.95Å; E1264-N1266 VanDerWaalsContact C-N 3.34Å
1265	L	83	Confident	80.2	Confident	33 Å²	33	61.2 Å²	61.2	17%	0.173	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	2.5	175.6	-64.3	-177.5	0	0	0	114.7	W1261 L1262 R1263 I1267 H1311	W1261-L1265 HydrophobicContact CD2-CD1 3.88Å; W1261-L1265 HydrophobicContact CE3-CD1 3.98Å; W1261-L1265 HydrophobicContact CH2-CD1 3.66Å; W1261-L1265 HydrophobicContact CZ2-CD1 3.52Å; W1261-L1265 HydrophobicContact CZ3-CD1 3.88Å; W1261-L1265 WeakPolarHBondContact O-CG 3.22Å; W1261-L1265 PolarHBondContact O-N 3.36Å; W1261-L1265 VanDerWaalsContact O-N 3.1Å; L1262-L1265 PolarHBondContact O-N 2.86Å; R1263-L1265 PolarHBondContact O-N 3.24Å; L1265-I1267 VanDerWaalsContact C-N 3.29Å; L1265-I1267 HydrophobicContact CB-CD1 4.23Å; L1265-I1267 HydrophobicContact CB-CG1 4.23Å; L1265-I1267 HydrophobicContact CD1-CD1 4.46Å; L1265-I1267 PolarHBondContact O-N 3.2Å; L1265-H1311 HydrophobicContact CD1-CB 3.71Å; L1265-H1311 HydrophobicContact CD2-CB 4.33Å
1266	N	80.2	Confident	81.2	Confident	137 Å²	137	61.5 Å²	61.5	73%	0.733	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	39.5	179.5	-127.8	15.3	0	0	0	113.2	L1262 R1263 E1264 R1307	L1262-N1266 PolarHBondContact O-N 3.43Å; R1263-N1266 PolarHBondContact O-N 2.91Å; R1263-N1266 VanDerWaalsContact O-N 3.09Å; E1264-N1266 VanDerWaalsContact C-N 3.34Å; N1266-R1307 PolarHBondContact O-NH1 3.01Å
1267	I	85	Confident	81.3	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.056	30%	0.301	C	S	.	.			trans	-83.4	138.8	172.5	-68.2	176.3	0	0	0	109.2	L1262 L1265 T1271 I1272 V1304 L1308	L1262-I1267 HydrophobicContact CD2-CD1 3.63Å; L1262-I1267 PolarHBondContact O-N 3.45Å; L1265-I1267 VanDerWaalsContact C-N 3.29Å; L1265-I1267 HydrophobicContact CB-CD1 4.23Å; L1265-I1267 HydrophobicContact CB-CG1 4.23Å; L1265-I1267 HydrophobicContact CD1-CD1 4.46Å; L1265-I1267 PolarHBondContact O-N 3.2Å; I1267-T1271 HydrophobicContact CG2-CG2 3.79Å; I1267-I1272 HydrophobicContact CG2-CG1 4.32Å; I1267-V1304 HydrophobicContact CG1-CG1 4.35Å; I1267-V1304 HydrophobicContact CG2-CG1 3.86Å; I1267-L1308 HydrophobicContact CD1-CB 4.08Å; I1267-L1308 HydrophobicContact CD1-CD1 3.68Å; I1267-L1308 HydrophobicContact CD1-CG 4.32Å
1268	D	79	Confident	81.1	Confident	50 Å²	50	65 Å²	65	27%	0.267	30%	0.303	S	S	.	.			trans	-64.3	147.5	-179.2	54.8	94.1	0	0	0	112.8	E1270 T1271 I1272 V1304	D1268-E1270 PolarHBondContact O-N 3.3Å; D1268-T1271 PolarHBondContact O-N 2.96Å; D1268-T1271 VanDerWaalsContact O-N 3.13Å; D1268-T1271 WeakPolarHBondContact OD1-CB 3.39Å; D1268-T1271 PolarHBondContact OD1-N 2.91Å; D1268-T1271 PolarHBondContact OD1-OG1 3.38Å; D1268-T1271 PolarHBondContact OD2-OG1 3.16Å; D1268-I1272 PolarHBondContact O-N 3.39Å; D1268-V1304 VanDerWaalsContact OD2-CG2 3.28Å; D1268-V1304 WeakPolarHBondContact OD2-CG2 3.26Å
1269	E	80.3	Confident	80.7	Confident	86 Å²	86	71.3 Å²	71.3	40%	0.402	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-30.5	-178	-70.3	-72	147.6	0	0	112.7	R1263 T1271 I1272 D1273	R1263-E1269 IonicContact CZ-OE1 2.7Å; R1263-E1269 VanDerWaalsContact CZ-OE1 3.3Å; R1263-E1269 IonicContact NE-OE1 3.91Å; R1263-E1269 PolarHBondContact NE-OE1 3.46Å; R1263-E1269 IonicContact NH2-OE1 2.65Å; R1263-E1269 PolarHBondContact NH2-OE1 3Å; R1263-E1269 IonicContact NH2-OE2 3Å; R1263-E1269 PolarHBondContact NH2-OE2 3.44Å; E1269-T1271 VanDerWaalsContact C-N 3.34Å; E1269-T1271 PolarHBondContact O-N 3.39Å; E1269-I1272 WeakPolarHBondContact O-CB 3.41Å; E1269-I1272 PolarHBondContact O-N 3.34Å; E1269-I1272 VanDerWaalsContact O-N 3.16Å; E1269-D1273 PolarHBondContact O-N 3.27Å
1270	E	76.5	Confident	80.4	Confident	103 Å²	103	73.2 Å²	73.2	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-43	176.1	-172.4	-175.7	167	0	0	111.3	D1268 D1273 I1274 R1301	D1268-E1270 PolarHBondContact O-N 3.3Å; E1270-D1273 PolarHBondContact O-N 3.07Å; E1270-I1274 VanDerWaalsContact O-CG1 3.31Å; E1270-I1274 WeakPolarHBondContact O-CG1 3.12Å; E1270-I1274 PolarHBondContact O-N 2.98Å; E1270-I1274 VanDerWaalsContact O-N 3.11Å; E1270-R1301 IonicContact OE1-CZ 3Å; E1270-R1301 IonicContact OE1-NH2 3.7Å; E1270-R1301 PolarHBondContact OE1-NH2 3.47Å; E1270-R1301 IonicContact OE2-CZ 3.3Å; E1270-R1301 VanDerWaalsContact OE2-CZ 3.32Å; E1270-R1301 IonicContact OE2-NH1 4Å; E1270-R1301 PolarHBondContact OE2-NH1 3.41Å; E1270-R1301 IonicContact OE2-NH2 3.1Å; E1270-R1301 PolarHBondContact OE2-NH2 3.36Å
1271	T	80.9	Confident	80.1	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-68.4	-37.1	174.1	-58.2	0	0	0	0	112.3	I1267 D1268 E1269 D1273 I1274 L1275 I1300 V1304	I1267-T1271 HydrophobicContact CG2-CG2 3.79Å; D1268-T1271 PolarHBondContact O-N 2.96Å; D1268-T1271 VanDerWaalsContact O-N 3.13Å; D1268-T1271 WeakPolarHBondContact OD1-CB 3.39Å; D1268-T1271 PolarHBondContact OD1-N 2.91Å; D1268-T1271 PolarHBondContact OD1-OG1 3.38Å; D1268-T1271 PolarHBondContact OD2-OG1 3.16Å; E1269-T1271 VanDerWaalsContact C-N 3.34Å; E1269-T1271 PolarHBondContact O-N 3.39Å; T1271-D1273 VanDerWaalsContact C-N 3.32Å; T1271-I1274 PolarHBondContact O-N 3.47Å; T1271-L1275 HydrophobicContact CG2-CD1 4.27Å; T1271-L1275 WeakPolarHBondContact O-CG 3.38Å; T1271-L1275 PolarHBondContact O-N 3.07Å; T1271-L1275 VanDerWaalsContact O-N 3.09Å; T1271-I1300 HydrophobicContact CG2-CB 4.45Å; T1271-I1300 HydrophobicContact CG2-CD1 4.22Å; T1271-I1300 HydrophobicContact CG2-CG1 4.11Å; T1271-I1300 HydrophobicContact CG2-CG2 3.65Å; T1271-V1304 HydrophobicContact CG2-CG1 3.87Å
1272	I	83.8	Confident	80	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-42.6	175.9	-64.4	174.7	0	0	0	110.2	V1259 L1262 R1263 I1267 D1268 E1269 L1275 K1276	V1259-I1272 HydrophobicContact CG1-CG2 4.39Å; V1259-I1272 HydrophobicContact CG2-CG2 4.38Å; L1262-I1272 HydrophobicContact CB-CD1 4.11Å; L1262-I1272 HydrophobicContact CB-CG1 3.95Å; L1262-I1272 HydrophobicContact CD1-CG1 4.01Å; L1262-I1272 HydrophobicContact CD1-CG2 4.47Å; R1263-I1272 HydrophobicContact CG-CD1 3.89Å; I1267-I1272 HydrophobicContact CG2-CG1 4.32Å; D1268-I1272 PolarHBondContact O-N 3.39Å; E1269-I1272 WeakPolarHBondContact O-CB 3.41Å; E1269-I1272 PolarHBondContact O-N 3.34Å; E1269-I1272 VanDerWaalsContact O-N 3.16Å; I1272-L1275 PolarHBondContact O-N 3.35Å; I1272-K1276 HydrophobicContact CG2-CD 4.32Å; I1272-K1276 WeakPolarHBondContact O-CG 3.45Å; I1272-K1276 PolarHBondContact O-N 3.07Å
1273	D	76.6	Confident	79.4	Confident	86 Å²	86	73.8 Å²	73.8	46%	0.46	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-38.7	179.3	-72.4	-22.6	0	0	0	112.2	E1269 E1270 T1271 K1276 F1277	E1269-D1273 PolarHBondContact O-N 3.27Å; E1270-D1273 PolarHBondContact O-N 3.07Å; T1271-D1273 VanDerWaalsContact C-N 3.32Å; D1273-K1276 PolarHBondContact O-N 2.95Å; D1273-F1277 VanDerWaalsContact O-CB 3.24Å; D1273-F1277 WeakPolarHBondContact O-CB 3.33Å; D1273-F1277 PolarHBondContact O-N 2.6Å
1274	I	79.1	Confident	79.1	Confident	46 Å²	46	69.9 Å²	69.9	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-59.2	-47.3	172.8	-69.3	165.5	0	0	0	110.6	E1270 T1271 K1276 F1277 E1278 V1298	E1270-I1274 VanDerWaalsContact O-CG1 3.31Å; E1270-I1274 WeakPolarHBondContact O-CG1 3.12Å; E1270-I1274 PolarHBondContact O-N 2.98Å; E1270-I1274 VanDerWaalsContact O-N 3.11Å; T1271-I1274 PolarHBondContact O-N 3.47Å; I1274-K1276 PolarHBondContact O-N 2.81Å; I1274-F1277 PolarHBondContact O-N 3.41Å; I1274-E1278 WeakPolarHBondContact O-CG 3.3Å; I1274-E1278 PolarHBondContact O-N 3.02Å; I1274-E1278 VanDerWaalsContact O-N 3.07Å; I1274-V1298 HydrophobicContact CG2-CG1 3.96Å; I1274-V1298 WeakPolarHBondContact CG2-O 3.13Å
1275	L	83.1	Confident	79.2	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-36.7	-179.6	-73.1	171.6	0	0	0	112.7	L1262 T1271 I1272 N1279 Y1280 L1285 I1300 L1308	L1262-L1275 HydrophobicContact CD1-CD1 3.77Å; L1262-L1275 HydrophobicContact CD2-CD1 4.29Å; T1271-L1275 HydrophobicContact CG2-CD1 4.27Å; T1271-L1275 WeakPolarHBondContact O-CG 3.38Å; T1271-L1275 PolarHBondContact O-N 3.07Å; T1271-L1275 VanDerWaalsContact O-N 3.09Å; I1272-L1275 PolarHBondContact O-N 3.35Å; L1275-N1279 PolarHBondContact O-N 2.97Å; L1275-Y1280 HydrophobicContact CD2-CD2 4Å; L1275-Y1280 HydrophobicContact CD2-CG 4.16Å; L1275-Y1280 PolarHBondContact O-N 3.22Å; L1275-L1285 HydrophobicContact CD1-CD1 4.14Å; L1275-L1285 HydrophobicContact CD2-CD2 3.98Å; L1275-I1300 HydrophobicContact CD1-CD1 4.2Å; L1275-I1300 HydrophobicContact CD2-CD1 3.63Å; L1275-I1300 HydrophobicContact CG-CD1 3.97Å; L1275-L1308 HydrophobicContact CD1-CD2 4.1Å
1276	K	75.3	Confident	79.1	Confident	80 Å²	80	62.5 Å²	62.5	35%	0.348	31%	0.308	S	S	.	.	H	α-helix	trans	-65.5	-44.8	172.3	-78.5	177.6	-178.8	170	0	112.1	V1259 I1272 D1273 I1274 E1278 N1279	V1259-K1276 HydrophobicContact CG2-CD 4.42Å; I1272-K1276 HydrophobicContact CG2-CD 4.32Å; I1272-K1276 WeakPolarHBondContact O-CG 3.45Å; I1272-K1276 PolarHBondContact O-N 3.07Å; D1273-K1276 PolarHBondContact O-N 2.95Å; I1274-K1276 PolarHBondContact O-N 2.81Å; K1276-E1278 VanDerWaalsContact C-N 3.25Å; K1276-E1278 PolarHBondContact O-N 3.04Å; K1276-N1279 WeakPolarHBondContact O-CA 3.45Å; K1276-N1279 PolarHBondContact O-N 3.39Å; K1276-N1279 PolarHBondContact O-OD1 3.29Å
1277	F	72.3	Confident	78.8	Confident	166 Å²	166	59.2 Å²	59.2	73%	0.728	30%	0.295	S	S	*	.	H	α-helix	trans	-61.3	-38.4	-178.8	-179.1	-95.9	0	0	0	111.4	D1273 I1274 N1279	D1273-F1277 VanDerWaalsContact O-CB 3.24Å; D1273-F1277 WeakPolarHBondContact O-CB 3.33Å; D1273-F1277 PolarHBondContact O-N 2.6Å; I1274-F1277 PolarHBondContact O-N 3.41Å; F1277-N1279 PolarHBondContact O-N 3.06Å
1278	E	75	Confident	78.2	Confident	105 Å²	105	62.1 Å²	62.1	49%	0.491	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	8.1	175.6	-64.5	-73.1	167.3	0	0	113.3	I1274 K1276 Y1280 V1298	I1274-E1278 WeakPolarHBondContact O-CG 3.3Å; I1274-E1278 PolarHBondContact O-N 3.02Å; I1274-E1278 VanDerWaalsContact O-N 3.07Å; K1276-E1278 VanDerWaalsContact C-N 3.25Å; K1276-E1278 PolarHBondContact O-N 3.04Å; E1278-Y1280 VanDerWaalsContact C-N 3.29Å; E1278-Y1280 HydrophobicContact CB-CD2 3.8Å; E1278-Y1280 HydrophobicContact CB-CE2 3.92Å; E1278-Y1280 PolarHBondContact O-N 3.29Å; E1278-V1298 HydrophobicContact CB-CG1 4.48Å; E1278-V1298 HydrophobicContact CG-CG1 3.95Å
1279	N	73.8	Confident	78.2	Confident	137 Å²	137	59.8 Å²	59.8	73%	0.733	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	32.7	178.2	-69.1	-38	0	0	0	115.5	L1275 K1276 F1277 S1281	L1275-N1279 PolarHBondContact O-N 2.97Å; K1276-N1279 WeakPolarHBondContact O-CA 3.45Å; K1276-N1279 PolarHBondContact O-N 3.39Å; K1276-N1279 PolarHBondContact O-OD1 3.29Å; F1277-N1279 PolarHBondContact O-N 3.06Å; N1279-S1281 PolarHBondContact O-N 2.99Å
1280	Y	78.3	Confident	77.9	Confident	52 Å²	52	62.6 Å²	62.6	20%	0.204	31%	0.314	C	S	.	.			trans	-67.2	133.2	172.1	-83.2	-93.2	0	0	0	110.8	L1258 L1275 E1278 D1284 L1285 V1289 V1298	L1258-Y1280 WeakPolarHBondContact CD2-O 3.2Å; L1275-Y1280 HydrophobicContact CD2-CD2 4Å; L1275-Y1280 HydrophobicContact CD2-CG 4.16Å; L1275-Y1280 PolarHBondContact O-N 3.22Å; E1278-Y1280 VanDerWaalsContact C-N 3.29Å; E1278-Y1280 HydrophobicContact CB-CD2 3.8Å; E1278-Y1280 HydrophobicContact CB-CE2 3.92Å; E1278-Y1280 PolarHBondContact O-N 3.29Å; Y1280-D1284 HydrophobicContact CD1-CB 3.78Å; Y1280-D1284 HydrophobicContact CE1-CB 4.45Å; Y1280-L1285 HydrophobicContact CD1-CD2 3.81Å; Y1280-L1285 HydrophobicContact CD1-CG 4.08Å; Y1280-L1285 HydrophobicContact CE1-CD2 4.26Å; Y1280-L1285 HydrophobicContact CG-CD2 4.32Å; Y1280-V1289 HydrophobicContact CE1-CG2 3.94Å; Y1280-V1298 HydrophobicContact CE2-CG1 4.28Å; Y1280-V1298 HydrophobicContact CE2-CG2 4.22Å
1281	S	79.1	Confident	77.8	Confident	33 Å²	33	59.6 Å²	59.6	23%	0.231	30%	0.304	C	S	.	.			trans	-89.6	166.9	161.4	73.5	0	0	0	0	111.5	N1279 E1283 D1284 L1285	N1279-S1281 PolarHBondContact O-N 2.99Å; S1281-E1283 PolarHBondContact O-N 2.67Å; S1281-E1283 PolarHBondContact OG-N 2.96Å; S1281-D1284 VanDerWaalsContact CB-OD2 3.24Å; S1281-D1284 WeakPolarHBondContact CB-OD2 3.19Å; S1281-D1284 PolarHBondContact N-OD2 2.68Å; S1281-D1284 PolarHBondContact O-N 3.37Å; S1281-D1284 PolarHBondContact OG-N 3.35Å; S1281-D1284 VanDerWaalsContact OG-N 3.09Å; S1281-D1284 PolarHBondContact OG-OD2 3.43Å; S1281-L1285 PolarHBondContact O-N 3.3Å; S1281-L1285 VanDerWaalsContact O-N 3.17Å
1282	L	82.3	Confident	77.5	Confident	37 Å²	37	64 Å²	64	19%	0.194	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-37.5	172.7	-179.5	61	0	0	0	111.3	L1258 W1261 L1285 L1286	L1258-L1282 HydrophobicContact CB-CB 4.18Å; L1258-L1282 HydrophobicContact CD1-CB 4.3Å; L1258-L1282 HydrophobicContact CD1-CD1 4.14Å; W1261-L1282 HydrophobicContact CB-CD1 4.18Å; W1261-L1282 HydrophobicContact CB-CD2 4.49Å; W1261-L1282 HydrophobicContact CD2-CD1 3.56Å; W1261-L1282 HydrophobicContact CE3-CD1 3.39Å; W1261-L1282 HydrophobicContact CG-CD1 3.93Å; W1261-L1282 HydrophobicContact CZ3-CD1 3.95Å; L1282-L1285 PolarHBondContact O-N 3.26Å; L1282-L1286 HydrophobicContact CD1-CD1 4.17Å; L1282-L1286 HydrophobicContact CD1-CG 4.39Å; L1282-L1286 HydrophobicContact CG-CD1 4.1Å; L1282-L1286 WeakPolarHBondContact O-CB 3.47Å; L1282-L1286 VanDerWaalsContact O-CG 3.28Å; L1282-L1286 WeakPolarHBondContact O-CG 3.47Å; L1282-L1286 PolarHBondContact O-N 2.94Å; L1282-L1286 VanDerWaalsContact O-N 3.14Å
1283	E	76	Confident	76.7	Confident	113 Å²	113	73.2 Å²	73.2	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-67.9	-36.8	177.1	-158.4	64.5	-162	0	0	111.3	S1281 L1285 L1286 C1287	S1281-E1283 PolarHBondContact O-N 2.67Å; S1281-E1283 PolarHBondContact OG-N 2.96Å; E1283-L1285 PolarHBondContact O-N 3.28Å; E1283-L1286 CarbonylContact O-C 3.53Å; E1283-L1286 PolarHBondContact O-N 3.5Å; E1283-C1287 VanDerWaalsContact O-CB 3.25Å; E1283-C1287 WeakPolarHBondContact O-CB 3.38Å; E1283-C1287 PolarHBondContact O-N 3.49Å; E1283-C1287 PolarHBondContact OE1-SG 3.47Å
1284	D	80.2	Confident	76.5	Confident	54 Å²	54	72 Å²	72	29%	0.289	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-42.5	176.7	-63.8	-48.7	0	0	0	112.3	Y1280 S1281 L1286 C1288 V1289	Y1280-D1284 HydrophobicContact CD1-CB 3.78Å; Y1280-D1284 HydrophobicContact CE1-CB 4.45Å; S1281-D1284 VanDerWaalsContact CB-OD2 3.24Å; S1281-D1284 WeakPolarHBondContact CB-OD2 3.19Å; S1281-D1284 PolarHBondContact N-OD2 2.68Å; S1281-D1284 PolarHBondContact O-N 3.37Å; S1281-D1284 PolarHBondContact OG-N 3.35Å; S1281-D1284 VanDerWaalsContact OG-N 3.09Å; S1281-D1284 PolarHBondContact OG-OD2 3.43Å; D1284-L1286 VanDerWaalsContact C-N 3.28Å; D1284-L1286 PolarHBondContact O-N 3.33Å; D1284-C1288 WeakPolarHBondContact O-CA 3.49Å; D1284-C1288 WeakPolarHBondContact O-CB 3.18Å; D1284-C1288 PolarHBondContact O-N 2.84Å; D1284-V1289 PolarHBondContact O-N 2.79Å
1285	L	83.2	Confident	76.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-37	174.7	-75.3	178.2	0	0	0	111.9	L1258 L1262 L1275 Y1280 S1281 L1282 E1283 V1289 L1295 I1312	L1258-L1285 HydrophobicContact CD1-CD1 3.51Å; L1262-L1285 HydrophobicContact CD2-CD1 4.47Å; L1275-L1285 HydrophobicContact CD1-CD1 4.14Å; L1275-L1285 HydrophobicContact CD2-CD2 3.98Å; Y1280-L1285 HydrophobicContact CD1-CD2 3.81Å; Y1280-L1285 HydrophobicContact CD1-CG 4.08Å; Y1280-L1285 HydrophobicContact CE1-CD2 4.26Å; Y1280-L1285 HydrophobicContact CG-CD2 4.32Å; S1281-L1285 PolarHBondContact O-N 3.3Å; S1281-L1285 VanDerWaalsContact O-N 3.17Å; L1282-L1285 PolarHBondContact O-N 3.26Å; E1283-L1285 PolarHBondContact O-N 3.28Å; L1285-V1289 HydrophobicContact CD2-CG2 3.91Å; L1285-L1295 HydrophobicContact CD2-CD2 4.01Å; L1285-I1312 HydrophobicContact CB-CD1 4.44Å
1286	L	81.6	Confident	76	Confident	12 Å²	12	73 Å²	73	6%	0.063	36%	0.355	C	S	.	.	H	α-helix	trans	-83.3	-26.7	-177.6	-67.8	179.4	0	0	0	113.8	W1261 L1282 E1283 D1284 I1312 K1315 R1316	W1261-L1286 HydrophobicContact CH2-CD2 4.44Å; L1282-L1286 HydrophobicContact CD1-CD1 4.17Å; L1282-L1286 HydrophobicContact CD1-CG 4.39Å; L1282-L1286 HydrophobicContact CG-CD1 4.1Å; L1282-L1286 WeakPolarHBondContact O-CB 3.47Å; L1282-L1286 VanDerWaalsContact O-CG 3.28Å; L1282-L1286 WeakPolarHBondContact O-CG 3.47Å; L1282-L1286 PolarHBondContact O-N 2.94Å; L1282-L1286 VanDerWaalsContact O-N 3.14Å; E1283-L1286 CarbonylContact O-C 3.53Å; E1283-L1286 PolarHBondContact O-N 3.5Å; D1284-L1286 VanDerWaalsContact C-N 3.28Å; D1284-L1286 PolarHBondContact O-N 3.33Å; L1286-I1312 HydrophobicContact CD2-CB 4.5Å; L1286-I1312 HydrophobicContact CD2-CG1 4.35Å; L1286-I1312 HydrophobicContact CD2-CG2 4.43Å; L1286-K1315 HydrophobicContact CD1-CG 3.85Å; L1286-K1315 HydrophobicContact CD2-CB 3.72Å; L1286-K1315 HydrophobicContact CD2-CG 3.87Å; L1286-R1316 VanDerWaalsContact C-NH2 3.32Å; L1286-R1316 PolarHBondContact O-NE 2.83Å; L1286-R1316 PolarHBondContact O-NH2 2.79Å
1287	C	73.8	Confident	75.5	Confident	68 Å²	68	79.1 Å²	79.1	46%	0.459	38%	0.376	S	S	.	.	H	α-helix	trans	-114.2	-34.3	-174.2	-68.9	0	0	0	0	112.8	E1283	E1283-C1287 VanDerWaalsContact O-CB 3.25Å; E1283-C1287 WeakPolarHBondContact O-CB 3.38Å; E1283-C1287 PolarHBondContact O-N 3.49Å; E1283-C1287 PolarHBondContact OE1-SG 3.47Å
1288	C	72.2	Confident	75.5	Confident	71 Å²	71	72.7 Å²	72.7	48%	0.48	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-32.1	-172.1	-58	0	0	0	0	113.6	D1284 K1290	D1284-C1288 WeakPolarHBondContact O-CA 3.49Å; D1284-C1288 WeakPolarHBondContact O-CB 3.18Å; D1284-C1288 PolarHBondContact O-N 2.84Å; C1288-K1290 PolarHBondContact O-N 3.32Å; C1288-K1290 VanDerWaalsContact O-N 3.16Å
1289	V	78.7	Confident	75.1	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.006	35%	0.35	C	S	.	.			trans	-74.1	105.9	178.9	-179.2	0	0	0	0	110.4	Y1280 D1284 L1285 E1294 L1295 W1309 R1316	Y1280-V1289 HydrophobicContact CE1-CG2 3.94Å; D1284-V1289 PolarHBondContact O-N 2.79Å; L1285-V1289 HydrophobicContact CD2-CG2 3.91Å; V1289-E1294 WeakPolarHBondContact CA-OE2 3.18Å; V1289-E1294 HydrophobicContact CG1-CB 4.33Å; V1289-L1295 HydrophobicContact CG1-CD1 4.41Å; V1289-L1295 HydrophobicContact CG1-CD2 3.86Å; V1289-L1295 HydrophobicContact CG1-CG 3.81Å; V1289-L1295 HydrophobicContact CG2-CD2 4.13Å; V1289-W1309 HydrophobicContact CB-CZ3 4.41Å; V1289-W1309 HydrophobicContact CG1-CE3 4.15Å; V1289-W1309 HydrophobicContact CG1-CZ3 3.74Å; V1289-W1309 VanDerWaalsContact O-CZ3 3.3Å; V1289-W1309 WeakPolarHBondContact O-CZ3 3.23Å; V1289-R1316 PolarHBondContact O-NH1 3.14Å; V1289-R1316 VanDerWaalsContact O-NH1 3.07Å; V1289-R1316 PolarHBondContact O-NH2 3.26Å
1290	K	73.6	Confident	75.2	Confident	145 Å²	145	63.5 Å²	63.5	63%	0.63	32%	0.315	S	S	*	.			trans	-92.9	-17.6	-175.3	-65.9	-170.8	-178.1	-178	0	113.6	C1288 E1294 W1309	C1288-K1290 PolarHBondContact O-N 3.32Å; C1288-K1290 VanDerWaalsContact O-N 3.16Å; K1290-E1294 PolarHBondContact N-OE2 2.85Å; K1290-W1309 VanDerWaalsContact O-CH2 3.29Å; K1290-W1309 WeakPolarHBondContact O-CH2 3.27Å
1291	S	75.7	Confident	74.6	Confident	40 Å²	40	67.7 Å²	67.7	28%	0.28	33%	0.331	S	S	.	.	S	Bend	trans	-148	155.1	177.8	73.8	0	0	0	0	113.1	R1293 E1294	S1291-R1293 PolarHBondContact O-N 3.13Å; S1291-R1293 VanDerWaalsContact O-N 3.13Å; S1291-R1293 PolarHBondContact OG-N 3.24Å; S1291-E1294 WeakPolarHBondContact O-CB 3.35Å; S1291-E1294 PolarHBondContact O-N 3.36Å; S1291-E1294 VanDerWaalsContact O-N 3.09Å
1292	R	73.3	Confident	73.9	Confident	96 Å²	96	69 Å²	69	36%	0.362	34%	0.343	S	S	.	.	H	α-helix	trans	-56.7	-29.1	171.4	-167.5	178	68.1	88.1	-2.3	112.6	E1294 L1295 V1296 W1309	R1292-E1294 VanDerWaalsContact C-N 3.26Å; R1292-E1294 PolarHBondContact O-N 2.93Å; R1292-L1295 PolarHBondContact O-N 2.81Å; R1292-V1296 PolarHBondContact O-N 3.01Å; R1292-W1309 HydrophobicContact CB-CB 4.29Å; R1292-W1309 HydrophobicContact CB-CD2 4.21Å; R1292-W1309 HydrophobicContact CB-CG 3.82Å; R1292-W1309 HydrophobicContact CG-CB 4.1Å; R1292-W1309 HydrophobicContact CG-CG 4.17Å
1293	R	67.7	Low	73.3	Confident	194 Å²	194	69.6 Å²	69.6	73%	0.732	36%	0.359	S	S	*	.	H	α-helix	trans	-64	-31.3	179.6	-72.5	-178	178.7	157.1	-0.5	112	S1291 V1296 R1297	S1291-R1293 PolarHBondContact O-N 3.13Å; S1291-R1293 VanDerWaalsContact O-N 3.13Å; S1291-R1293 PolarHBondContact OG-N 3.24Å; R1293-V1296 PolarHBondContact O-N 3.31Å; R1293-R1297 WeakPolarHBondContact O-CG 3.47Å; R1293-R1297 PolarHBondContact O-N 3.12Å
1294	E	73.4	Confident	73.4	Confident	60 Å²	60	64.6 Å²	64.6	28%	0.28	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-43	176.7	-73.1	165.4	-168.4	0	0	111.4	V1289 K1290 S1291 R1292 V1296 R1297 V1298	V1289-E1294 WeakPolarHBondContact CA-OE2 3.18Å; V1289-E1294 HydrophobicContact CG1-CB 4.33Å; K1290-E1294 PolarHBondContact N-OE2 2.85Å; S1291-E1294 WeakPolarHBondContact O-CB 3.35Å; S1291-E1294 PolarHBondContact O-N 3.36Å; S1291-E1294 VanDerWaalsContact O-N 3.09Å; R1292-E1294 VanDerWaalsContact C-N 3.26Å; R1292-E1294 PolarHBondContact O-N 2.93Å; E1294-V1296 VanDerWaalsContact C-N 3.28Å; E1294-V1296 PolarHBondContact O-N 2.99Å; E1294-R1297 WeakPolarHBondContact O-CB 3.09Å; E1294-R1297 PolarHBondContact O-N 3.48Å; E1294-R1297 VanDerWaalsContact O-N 3.1Å; E1294-V1298 WeakPolarHBondContact O-CG2 3.32Å; E1294-V1298 PolarHBondContact O-N 3.39Å; E1294-V1298 VanDerWaalsContact O-N 3.08Å
1295	L	78.3	Confident	73.5	Confident	1 Å²	1	62 Å²	62	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-40.7	173.9	-62	175.2	0	0	0	111.8	L1285 V1289 R1292 V1298 I1300 L1308 W1309 I1312	L1285-L1295 HydrophobicContact CD2-CD2 4.01Å; V1289-L1295 HydrophobicContact CG1-CD1 4.41Å; V1289-L1295 HydrophobicContact CG1-CD2 3.86Å; V1289-L1295 HydrophobicContact CG1-CG 3.81Å; V1289-L1295 HydrophobicContact CG2-CD2 4.13Å; R1292-L1295 PolarHBondContact O-N 2.81Å; L1295-V1298 PolarHBondContact O-N 2.88Å; L1295-I1300 HydrophobicContact CB-CB 4.49Å; L1295-I1300 HydrophobicContact CB-CD1 4.16Å; L1295-I1300 HydrophobicContact CD2-CD1 3.93Å; L1295-I1300 VanDerWaalsContact O-CB 3.23Å; L1295-I1300 WeakPolarHBondContact O-CB 3.44Å; L1295-I1300 WeakPolarHBondContact O-CG1 3.44Å; L1295-I1300 PolarHBondContact O-N 3.35Å; L1295-I1300 VanDerWaalsContact O-N 3.09Å; L1295-L1308 HydrophobicContact CD1-CB 4.4Å; L1295-L1308 HydrophobicContact CD1-CD2 4.2Å; L1295-L1308 HydrophobicContact CD1-CG 4.22Å; L1295-L1308 HydrophobicContact CD2-CD2 4.06Å; L1295-W1309 HydrophobicContact CD1-CB 4.11Å; L1295-W1309 HydrophobicContact CD1-CE3 4.34Å; L1295-I1312 HydrophobicContact CD1-CD1 4.2Å
1296	V	71.8	Confident	73	Confident	68 Å²	68	65 Å²	65	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-67.3	-35.9	176.9	177.3	0	0	0	0	111.6	R1292 R1293 E1294 V1298 G1299 S1305	R1292-V1296 PolarHBondContact O-N 3.01Å; R1293-V1296 PolarHBondContact O-N 3.31Å; E1294-V1296 VanDerWaalsContact C-N 3.28Å; E1294-V1296 PolarHBondContact O-N 2.99Å; V1296-V1298 VanDerWaalsContact C-N 3.33Å; V1296-G1299 PolarHBondContact O-N 2.87Å; V1296-G1299 VanDerWaalsContact O-N 3.09Å; V1296-S1305 WeakPolarHBondContact CG2-OG 3.33Å
1297	R	65.3	Low	72.8	Confident	208 Å²	208	70.1 Å²	70.1	79%	0.785	36%	0.361	S	S	*	.	H	α-helix	trans	-66	-34.6	176.2	-78	179.2	-176.4	167.1	-0.2	112.9	R1293 E1294 G1299	R1293-R1297 WeakPolarHBondContact O-CG 3.47Å; R1293-R1297 PolarHBondContact O-N 3.12Å; E1294-R1297 WeakPolarHBondContact O-CB 3.09Å; E1294-R1297 PolarHBondContact O-N 3.48Å; E1294-R1297 VanDerWaalsContact O-N 3.1Å; R1297-G1299 PolarHBondContact O-N 3.37Å
1298	V	72.7	Confident	73.3	Confident	32 Å²	32	66.9 Å²	66.9	19%	0.194	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.3	174.3	178.9	0	0	0	0	111.8	I1274 E1278 Y1280 E1294 L1295 V1296	I1274-V1298 HydrophobicContact CG2-CG1 3.96Å; I1274-V1298 WeakPolarHBondContact CG2-O 3.13Å; E1278-V1298 HydrophobicContact CB-CG1 4.48Å; E1278-V1298 HydrophobicContact CG-CG1 3.95Å; Y1280-V1298 HydrophobicContact CE2-CG1 4.28Å; Y1280-V1298 HydrophobicContact CE2-CG2 4.22Å; E1294-V1298 WeakPolarHBondContact O-CG2 3.32Å; E1294-V1298 PolarHBondContact O-N 3.39Å; E1294-V1298 VanDerWaalsContact O-N 3.08Å; L1295-V1298 PolarHBondContact O-N 2.88Å; V1296-V1298 VanDerWaalsContact C-N 3.33Å
1299	G	67	Low	74.1	Confident	46 Å²	46	65.1 Å²	65.1	47%	0.474	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	6.9	177.7	0	0	0	0	0	114.2	V1296 R1297 R1301	V1296-G1299 PolarHBondContact O-N 2.87Å; V1296-G1299 VanDerWaalsContact O-N 3.09Å; R1297-G1299 PolarHBondContact O-N 3.37Å; G1299-R1301 PolarHBondContact O-N 3.43Å
1300	I	74.2	Confident	74.2	Confident	2 Å²	2	71 Å²	71	1%	0.01	35%	0.348	C	S	.	.			trans	-75.5	123.9	178.8	-52.2	177.6	0	0	0	110.1	T1271 L1275 L1295 V1304 L1308	T1271-I1300 HydrophobicContact CG2-CB 4.45Å; T1271-I1300 HydrophobicContact CG2-CD1 4.22Å; T1271-I1300 HydrophobicContact CG2-CG1 4.11Å; T1271-I1300 HydrophobicContact CG2-CG2 3.65Å; L1275-I1300 HydrophobicContact CD1-CD1 4.2Å; L1275-I1300 HydrophobicContact CD2-CD1 3.63Å; L1275-I1300 HydrophobicContact CG-CD1 3.97Å; L1295-I1300 HydrophobicContact CB-CB 4.49Å; L1295-I1300 HydrophobicContact CB-CD1 4.16Å; L1295-I1300 HydrophobicContact CD2-CD1 3.93Å; L1295-I1300 VanDerWaalsContact O-CB 3.23Å; L1295-I1300 WeakPolarHBondContact O-CB 3.44Å; L1295-I1300 WeakPolarHBondContact O-CG1 3.44Å; L1295-I1300 PolarHBondContact O-N 3.35Å; L1295-I1300 VanDerWaalsContact O-N 3.09Å; I1300-V1304 HydrophobicContact CG2-CB 3.98Å; I1300-V1304 HydrophobicContact CG2-CG1 3.99Å; I1300-L1308 HydrophobicContact CD1-CD2 4.09Å
1301	R	67.4	Low	74.7	Confident	140 Å²	140	66.7 Å²	66.7	53%	0.528	33%	0.33	S	S	.	.			trans	-54.5	143	-177.8	-64.3	179	-178.4	157.5	4.9	111.8	E1270 G1299 G1303 V1304 S1305	E1270-R1301 IonicContact OE1-CZ 3Å; E1270-R1301 IonicContact OE1-NH2 3.7Å; E1270-R1301 PolarHBondContact OE1-NH2 3.47Å; E1270-R1301 IonicContact OE2-CZ 3.3Å; E1270-R1301 VanDerWaalsContact OE2-CZ 3.32Å; E1270-R1301 IonicContact OE2-NH1 4Å; E1270-R1301 PolarHBondContact OE2-NH1 3.41Å; E1270-R1301 IonicContact OE2-NH2 3.1Å; E1270-R1301 PolarHBondContact OE2-NH2 3.36Å; G1299-R1301 PolarHBondContact O-N 3.43Å; R1301-G1303 VanDerWaalsContact C-N 3.33Å; R1301-G1303 PolarHBondContact O-N 3Å; R1301-G1303 VanDerWaalsContact O-N 3.16Å; R1301-V1304 HydrophobicContact CB-CG2 4.34Å; R1301-V1304 PolarHBondContact O-N 3.37Å; R1301-S1305 PolarHBondContact O-N 3.36Å; R1301-S1305 PolarHBondContact O-OG 2.88Å
1302	A	64.3	Low	75.1	Confident	60 Å²	60	64.8 Å²	64.8	50%	0.496	32%	0.316	S	S	.	.	H	α-helix	trans	-53.1	-41.6	-172.6	0	0	0	0	0	114.7	S1305 C1306	A1302-S1305 WeakPolarHBondContact CA-OG 3.27Å; A1302-S1305 PolarHBondContact O-OG 3.47Å; A1302-C1306 WeakPolarHBondContact O-CB 3.45Å; A1302-C1306 PolarHBondContact O-N 3.43Å; A1302-C1306 PolarHBondContact O-SG 3.2Å
1303	G	68.5	Low	75.5	Confident	50 Å²	50	65.9 Å²	65.9	52%	0.515	32%	0.324	S	S	.	.	H	α-helix	trans	-68.7	-37.5	177.8	0	0	0	0	0	113.5	R1301 R1307	R1301-G1303 VanDerWaalsContact C-N 3.33Å; R1301-G1303 PolarHBondContact O-N 3Å; R1301-G1303 VanDerWaalsContact O-N 3.16Å; G1303-R1307 PolarHBondContact O-N 3.49Å
1304	V	79	Confident	76.1	Confident	9 Å²	9	60.6 Å²	60.6	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-73.6	-39.8	176.4	-174	0	0	0	0	110.2	I1267 D1268 T1271 I1300 R1301 C1306 R1307 L1308	I1267-V1304 HydrophobicContact CG1-CG1 4.35Å; I1267-V1304 HydrophobicContact CG2-CG1 3.86Å; D1268-V1304 VanDerWaalsContact OD2-CG2 3.28Å; D1268-V1304 WeakPolarHBondContact OD2-CG2 3.26Å; T1271-V1304 HydrophobicContact CG2-CG1 3.87Å; I1300-V1304 HydrophobicContact CG2-CB 3.98Å; I1300-V1304 HydrophobicContact CG2-CG1 3.99Å; R1301-V1304 HydrophobicContact CB-CG2 4.34Å; R1301-V1304 PolarHBondContact O-N 3.37Å; V1304-C1306 VanDerWaalsContact C-N 3.32Å; V1304-C1306 PolarHBondContact O-N 2.95Å; V1304-R1307 PolarHBondContact O-N 2.88Å; V1304-L1308 VanDerWaalsContact O-CB 3.29Å; V1304-L1308 WeakPolarHBondContact O-CB 3.17Å; V1304-L1308 PolarHBondContact O-N 3.43Å
1305	S	81.1	Confident	76.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.6	-33.7	175.5	72	0	0	0	0	112.3	V1296 R1301 A1302 W1309	V1296-S1305 WeakPolarHBondContact CG2-OG 3.33Å; R1301-S1305 PolarHBondContact O-N 3.36Å; R1301-S1305 PolarHBondContact O-OG 2.88Å; A1302-S1305 WeakPolarHBondContact CA-OG 3.27Å; A1302-S1305 PolarHBondContact O-OG 3.47Å; S1305-W1309 WeakPolarHBondContact O-CB 3.45Å; S1305-W1309 PolarHBondContact O-N 2.91Å
1306	C	73.2	Confident	76.4	Confident	62 Å²	62	63.8 Å²	63.8	42%	0.419	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-47.5	170.5	-77.1	0	0	0	0	112.2	A1302 V1304 K1310	A1302-C1306 WeakPolarHBondContact O-CB 3.45Å; A1302-C1306 PolarHBondContact O-N 3.43Å; A1302-C1306 PolarHBondContact O-SG 3.2Å; V1304-C1306 VanDerWaalsContact C-N 3.32Å; V1304-C1306 PolarHBondContact O-N 2.95Å; C1306-K1310 WeakPolarHBondContact O-CB 3.38Å; C1306-K1310 PolarHBondContact O-N 2.96Å
1307	R	78.2	Confident	76.5	Confident	119 Å²	119	68.5 Å²	68.5	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-50.6	177.2	-77.6	-172.7	-76.7	162.8	-2.7	111.8	N1266 G1303 V1304 W1309 K1310 H1311	N1266-R1307 PolarHBondContact O-NH1 3.01Å; G1303-R1307 PolarHBondContact O-N 3.49Å; V1304-R1307 PolarHBondContact O-N 2.88Å; R1307-W1309 PolarHBondContact O-N 3.25Å; R1307-K1310 WeakPolarHBondContact O-CB 3.28Å; R1307-K1310 PolarHBondContact O-N 2.87Å; R1307-H1311 PolarHBondContact O-CD2 3.15Å; R1307-H1311 PolarHBondContact O-N 2.54Å; R1307-H1311 VanDerWaalsContact O-N 3.11Å
1308	L	84.5	Confident	76.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-44.2	178.8	-177.2	58.9	0	0	0	111.4	W1261 L1262 I1267 L1275 L1295 I1300 V1304 K1310 H1311 I1312	W1261-L1308 HydrophobicContact CH2-CD1 4.08Å; W1261-L1308 HydrophobicContact CZ3-CD1 3.73Å; L1262-L1308 HydrophobicContact CD2-CD1 3.76Å; I1267-L1308 HydrophobicContact CD1-CB 4.08Å; I1267-L1308 HydrophobicContact CD1-CD1 3.68Å; I1267-L1308 HydrophobicContact CD1-CG 4.32Å; L1275-L1308 HydrophobicContact CD1-CD2 4.1Å; L1295-L1308 HydrophobicContact CD1-CB 4.4Å; L1295-L1308 HydrophobicContact CD1-CD2 4.2Å; L1295-L1308 HydrophobicContact CD1-CG 4.22Å; L1295-L1308 HydrophobicContact CD2-CD2 4.06Å; I1300-L1308 HydrophobicContact CD1-CD2 4.09Å; V1304-L1308 VanDerWaalsContact O-CB 3.29Å; V1304-L1308 WeakPolarHBondContact O-CB 3.17Å; V1304-L1308 PolarHBondContact O-N 3.43Å; L1308-K1310 VanDerWaalsContact C-N 3.34Å; L1308-K1310 PolarHBondContact O-N 3.27Å; L1308-H1311 PolarHBondContact O-N 3.04Å; L1308-I1312 HydrophobicContact CD1-CD1 4.43Å; L1308-I1312 HydrophobicContact CG-CD1 4.05Å; L1308-I1312 VanDerWaalsContact O-CG1 3.32Å; L1308-I1312 WeakPolarHBondContact O-CG1 3.49Å; L1308-I1312 PolarHBondContact O-N 3.22Å
1309	W	87.2	Confident	76.7	Confident	34 Å²	34	69.2 Å²	69.2	13%	0.129	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-37.7	176.7	-173.1	-125.6	0	0	0	112.8	V1289 K1290 R1292 L1295 S1305 R1307 I1312 K1313	V1289-W1309 HydrophobicContact CB-CZ3 4.41Å; V1289-W1309 HydrophobicContact CG1-CE3 4.15Å; V1289-W1309 HydrophobicContact CG1-CZ3 3.74Å; V1289-W1309 VanDerWaalsContact O-CZ3 3.3Å; V1289-W1309 WeakPolarHBondContact O-CZ3 3.23Å; K1290-W1309 VanDerWaalsContact O-CH2 3.29Å; K1290-W1309 WeakPolarHBondContact O-CH2 3.27Å; R1292-W1309 HydrophobicContact CB-CB 4.29Å; R1292-W1309 HydrophobicContact CB-CD2 4.21Å; R1292-W1309 HydrophobicContact CB-CG 3.82Å; R1292-W1309 HydrophobicContact CG-CB 4.1Å; R1292-W1309 HydrophobicContact CG-CG 4.17Å; L1295-W1309 HydrophobicContact CD1-CB 4.11Å; L1295-W1309 HydrophobicContact CD1-CE3 4.34Å; S1305-W1309 WeakPolarHBondContact O-CB 3.45Å; S1305-W1309 PolarHBondContact O-N 2.91Å; R1307-W1309 PolarHBondContact O-N 3.25Å; W1309-I1312 HydrophobicContact CE3-CB 4.25Å; W1309-I1312 HydrophobicContact CE3-CD1 4.1Å; W1309-I1312 HydrophobicContact CE3-CG2 4.16Å; W1309-I1312 HydrophobicContact CZ3-CG2 3.96Å; W1309-I1312 PolarHBondContact O-N 3.37Å; W1309-K1313 VanDerWaalsContact CD1-CE 3.43Å; W1309-K1313 WeakPolarHBondContact O-CG 3.37Å; W1309-K1313 PolarHBondContact O-N 2.74Å
1310	K	82.5	Confident	75.9	Confident	126 Å²	126	69.8 Å²	69.8	55%	0.548	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-46.9	173.7	-175	-176.8	174.1	-173.2	0	111	C1306 R1307 L1308 K1313 E1314	C1306-K1310 WeakPolarHBondContact O-CB 3.38Å; C1306-K1310 PolarHBondContact O-N 2.96Å; R1307-K1310 WeakPolarHBondContact O-CB 3.28Å; R1307-K1310 PolarHBondContact O-N 2.87Å; L1308-K1310 VanDerWaalsContact C-N 3.34Å; L1308-K1310 PolarHBondContact O-N 3.27Å; K1310-K1313 PolarHBondContact O-N 3.23Å; K1310-E1314 WeakPolarHBondContact CE-OE1 3.07Å; K1310-E1314 WeakPolarHBondContact O-CG 3.46Å; K1310-E1314 PolarHBondContact O-N 3.29Å
1311	H	83.4	Confident	74.4	Confident	54 Å²	54	74.8 Å²	74.8	25%	0.25	38%	0.38	C	S	.	.	H	α-helix	trans	-68.8	-35.1	178.8	-70.1	-57.5	0	0	0	113.4	W1261 L1265 R1307 L1308 K1313 E1314 K1315	W1261-H1311 HydrophobicContact CH2-CB 4.2Å; W1261-H1311 HydrophobicContact CZ2-CB 4.04Å; L1265-H1311 HydrophobicContact CD1-CB 3.71Å; L1265-H1311 HydrophobicContact CD2-CB 4.33Å; R1307-H1311 PolarHBondContact O-CD2 3.15Å; R1307-H1311 PolarHBondContact O-N 2.54Å; R1307-H1311 VanDerWaalsContact O-N 3.11Å; L1308-H1311 PolarHBondContact O-N 3.04Å; H1311-K1313 VanDerWaalsContact C-N 3.35Å; H1311-E1314 IonicContact CE1-OE2 3.63Å; H1311-E1314 IonicContact ND1-OE2 3.26Å; H1311-E1314 PolarHBondContact ND1-OE2 2.96Å; H1311-E1314 PolarHBondContact O-N 2.74Å; H1311-K1315 WeakPolarHBondContact O-CB 3.49Å; H1311-K1315 PolarHBondContact O-N 3.4Å
1312	I	84.6	Confident	73.3	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-58.4	-47.6	170.9	-70.1	164.6	0	0	0	110.1	W1261 L1285 L1286 L1295 L1308 W1309 K1315 R1316	W1261-I1312 HydrophobicContact CH2-CG1 4.34Å; L1285-I1312 HydrophobicContact CB-CD1 4.44Å; L1286-I1312 HydrophobicContact CD2-CB 4.5Å; L1286-I1312 HydrophobicContact CD2-CG1 4.35Å; L1286-I1312 HydrophobicContact CD2-CG2 4.43Å; L1295-I1312 HydrophobicContact CD1-CD1 4.2Å; L1308-I1312 HydrophobicContact CD1-CD1 4.43Å; L1308-I1312 HydrophobicContact CG-CD1 4.05Å; L1308-I1312 VanDerWaalsContact O-CG1 3.32Å; L1308-I1312 WeakPolarHBondContact O-CG1 3.49Å; L1308-I1312 PolarHBondContact O-N 3.22Å; W1309-I1312 HydrophobicContact CE3-CB 4.25Å; W1309-I1312 HydrophobicContact CE3-CD1 4.1Å; W1309-I1312 HydrophobicContact CE3-CG2 4.16Å; W1309-I1312 HydrophobicContact CZ3-CG2 3.96Å; W1309-I1312 PolarHBondContact O-N 3.37Å; I1312-K1315 PolarHBondContact O-N 2.91Å; I1312-R1316 WeakPolarHBondContact O-CG 3.24Å; I1312-R1316 PolarHBondContact O-N 3.39Å
1313	K	82.2	Confident	71.9	Confident	118 Å²	118	75 Å²	75	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-62	-44.4	176.7	-70.1	-172.3	-163.7	-168.8	0	112.7	W1309 K1310 H1311 K1315 R1316 K1317	W1309-K1313 VanDerWaalsContact CD1-CE 3.43Å; W1309-K1313 WeakPolarHBondContact O-CG 3.37Å; W1309-K1313 PolarHBondContact O-N 2.74Å; K1310-K1313 PolarHBondContact O-N 3.23Å; H1311-K1313 VanDerWaalsContact C-N 3.35Å; K1313-K1315 VanDerWaalsContact C-N 3.34Å; K1313-K1315 PolarHBondContact O-N 2.97Å; K1313-R1316 PolarHBondContact O-N 2.69Å; K1313-K1317 PolarHBondContact O-N 2.8Å; K1313-K1317 VanDerWaalsContact O-N 3.09Å
1314	E	80.1	Confident	70.3	Confident	84 Å²	84	79.9 Å²	79.9	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-62.2	-41.1	179.1	-76.3	171.1	178.5	0	0	111.7	K1310 H1311 K1317 Q1318	K1310-E1314 WeakPolarHBondContact CE-OE1 3.07Å; K1310-E1314 WeakPolarHBondContact O-CG 3.46Å; K1310-E1314 PolarHBondContact O-N 3.29Å; H1311-E1314 IonicContact CE1-OE2 3.63Å; H1311-E1314 IonicContact ND1-OE2 3.26Å; H1311-E1314 PolarHBondContact ND1-OE2 2.96Å; H1311-E1314 PolarHBondContact O-N 2.74Å; E1314-K1317 PolarHBondContact O-N 2.77Å; E1314-Q1318 PolarHBondContact O-N 3.44Å; E1314-Q1318 VanDerWaalsContact O-N 3.17Å
1315	K	79.2	Confident	68.1	Low	75 Å²	75	88.6 Å²	88.6	33%	0.326	45%	0.449	S	S	.	.	H	α-helix	trans	-70	-39.6	179.5	-161.5	67.9	175	175.9	0	112.6	L1286 H1311 I1312 K1313 K1317 Q1318 N1319	L1286-K1315 HydrophobicContact CD1-CG 3.85Å; L1286-K1315 HydrophobicContact CD2-CB 3.72Å; L1286-K1315 HydrophobicContact CD2-CG 3.87Å; H1311-K1315 WeakPolarHBondContact O-CB 3.49Å; H1311-K1315 PolarHBondContact O-N 3.4Å; I1312-K1315 PolarHBondContact O-N 2.91Å; K1313-K1315 VanDerWaalsContact C-N 3.34Å; K1313-K1315 PolarHBondContact O-N 2.97Å; K1315-K1317 VanDerWaalsContact C-N 3.32Å; K1315-K1317 PolarHBondContact O-N 3.35Å; K1315-Q1318 PolarHBondContact O-N 3.22Å; K1315-N1319 PolarHBondContact O-N 3.23Å; K1315-N1319 VanDerWaalsContact O-N 3.09Å
1316	R	78.7	Confident	65.6	Low	52 Å²	52	97.3 Å²	97.3	20%	0.196	49%	0.49	C	S	.	.	H	α-helix	trans	-58.4	-43.5	171.6	-74.9	177.4	177.2	159.3	7.5	112.1	L1286 V1289 I1312 K1313 Q1318 N1319 G1320 D1321	L1286-R1316 VanDerWaalsContact C-NH2 3.32Å; L1286-R1316 PolarHBondContact O-NE 2.83Å; L1286-R1316 PolarHBondContact O-NH2 2.79Å; V1289-R1316 PolarHBondContact O-NH1 3.14Å; V1289-R1316 VanDerWaalsContact O-NH1 3.07Å; V1289-R1316 PolarHBondContact O-NH2 3.26Å; I1312-R1316 WeakPolarHBondContact O-CG 3.24Å; I1312-R1316 PolarHBondContact O-N 3.39Å; K1313-R1316 PolarHBondContact O-N 2.69Å; R1316-Q1318 VanDerWaalsContact C-N 3.27Å; R1316-Q1318 PolarHBondContact O-N 2.96Å; R1316-N1319 PolarHBondContact O-N 3.49Å; R1316-N1319 VanDerWaalsContact O-N 3.15Å; R1316-G1320 PolarHBondContact O-N 3.47Å; R1316-D1321 PolarHBondContact O-N 2.98Å
1317	K	72.6	Confident	63.5	Low	168 Å²	168	100.5 Å²	100.5	73%	0.73	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-33.6	177.3	-166.2	178	-178.7	-179.7	0	112.4	K1313 E1314 K1315	K1313-K1317 PolarHBondContact O-N 2.8Å; K1313-K1317 VanDerWaalsContact O-N 3.09Å; E1314-K1317 PolarHBondContact O-N 2.77Å; K1315-K1317 VanDerWaalsContact C-N 3.32Å; K1315-K1317 PolarHBondContact O-N 3.35Å
1318	Q	72.8	Confident	61	Low	141 Å²	141	102.5 Å²	102.5	66%	0.659	53%	0.529	S	S	*	.	H	α-helix	trans	-72.6	-34.5	174.3	-71.8	178.1	-1	0	0	113.1	E1314 K1315 R1316 G1320	E1314-Q1318 PolarHBondContact O-N 3.44Å; E1314-Q1318 VanDerWaalsContact O-N 3.17Å; K1315-Q1318 PolarHBondContact O-N 3.22Å; R1316-Q1318 VanDerWaalsContact C-N 3.27Å; R1316-Q1318 PolarHBondContact O-N 2.96Å; Q1318-G1320 VanDerWaalsContact C-N 3.27Å; Q1318-G1320 PolarHBondContact O-N 3.49Å
1319	N	70.1	Confident	58.3	Low	113 Å²	113	107.7 Å²	107.7	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-80.8	-1.2	-180	-74	1.8	0	0	0	114	K1315 R1316	K1315-N1319 PolarHBondContact O-N 3.23Å; K1315-N1319 VanDerWaalsContact O-N 3.09Å; R1316-N1319 PolarHBondContact O-N 3.49Å; R1316-N1319 VanDerWaalsContact O-N 3.15Å
1320	G	49.4	Very low	55.4	Low	58 Å²	58	112.1 Å²	112.1	60%	0.598	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.2	12	174.8	0	0	0	0	0	115.5	R1316 Q1318 N1322	R1316-G1320 PolarHBondContact O-N 3.47Å; Q1318-G1320 VanDerWaalsContact C-N 3.27Å; Q1318-G1320 PolarHBondContact O-N 3.49Å; G1320-N1322 PolarHBondContact O-N 2.94Å
1321	D	44.5	Very low	52.7	Low	107 Å²	107	113.1 Å²	113.1	57%	0.572	62%	0.62	S	S	*	*			trans	-88.9	99.2	179.2	-158.9	5.4	0	0	0	110.7	R1316	R1316-D1321 PolarHBondContact O-N 2.98Å
1322	N	44.1	Very low	50	Low	154 Å²	154	114.1 Å²	114.1	82%	0.824	65%	0.645	S	S	*	*			trans	-96.3	33.1	-179	-80.4	-21	0	0	0	112.7	G1320	G1320-N1322 PolarHBondContact O-N 2.94Å
1323	G	35.2	Very low	47	Very low	52 Å²	52	119.7 Å²	119.7	54%	0.536	68%	0.683	S	S	.	*			trans	-97.9	131.8	-177.9	0	0	0	0	0	114.6
1324	L	33.3	Very low	44.3	Very low	152 Å²	152	119.1 Å²	119.1	80%	0.796	69%	0.694	S	S	*	*			trans	98.5	74.5	165.6	-52.6	168.8	0	0	0	116.5
1325	E	32.6	Very low	41.6	Very low	191 Å²	191	120.5 Å²	120.5	89%	0.893	71%	0.712	S	S	*	*			trans	-63.8	134.8	148.1	-71.1	-176.6	149	0	0	110
1326	E	30.2	Very low	39	Very low	183 Å²	183	121.6 Å²	121.6	86%	0.855	73%	0.729	S	S	*	*			trans	-60.7	127.7	175.1	-76.9	177.5	145.9	0	0	110.6	L1328	E1326-L1328 PolarHBondContact O-N 3.18Å; E1326-L1328 VanDerWaalsContact O-N 3.08Å
1327	P	27.6	Very low	36.3	Very low	130 Å²	130	128.1 Å²	128.1	84%	0.844	76%	0.761	S	S	*	*			trans	-68	112.7	175.5	-10.9	25	0	0	0	109.8	A1329	P1327-A1329 PolarHBondContact O-N 2.87Å
1328	L	26.7	Very low	34.2	Very low	161 Å²	161	125 Å²	125	84%	0.843	77%	0.768	S	S	*	*			trans	-58.4	117	165.5	-80.5	151.8	0	0	0	108.9	E1326 T1330	E1326-L1328 PolarHBondContact O-N 3.18Å; E1326-L1328 VanDerWaalsContact O-N 3.08Å; L1328-T1330 VanDerWaalsContact C-N 3.33Å; L1328-T1330 PolarHBondContact O-N 3.08Å
1329	A	27.9	Very low	31.9	Very low	108 Å²	108	121.6 Å²	121.6	89%	0.893	77%	0.77	S	S	*	*			trans	-65.4	90.3	173.3	0	0	0	0	0	110	P1327	P1327-A1329 PolarHBondContact O-N 2.87Å
1330	T	27.1	Very low	29.9	Very low	127 Å²	127	121.8 Å²	121.8	78%	0.779	78%	0.78	S	S	*	*			trans	-80	122.2	166.3	47.4	0	0	0	0	109.7	L1328 G1332	L1328-T1330 VanDerWaalsContact C-N 3.33Å; L1328-T1330 PolarHBondContact O-N 3.08Å; T1330-G1332 PolarHBondContact O-N 3.08Å
1331	T	24.6	Very low	28.7	Very low	148 Å²	148	126.6 Å²	126.6	91%	0.908	79%	0.792	S	S	*	*			trans	-53.3	111.3	164.5	48.1	0	0	0	0	110.7
1332	G	26.2	Very low	28.5	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	82%	0.823	S	S	*	*			trans	-128	95.9	171.2	0	0	0	0	0	109.4	T1330	T1330-G1332 PolarHBondContact O-N 3.08Å
1333	S	22.7	Very low	27.8	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	82%	0.823	S	S	*	*			trans	-66.8	125	161.4	55.3	0	0	0	0	109.8
1334	S	24.5	Very low	27.4	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	84%	0.839	S	S	*	*			trans	158.5	136.9	134	60.5	0	0	0	0	112
1335	C	24.7	Very low	27	Very low	113 Å²	113	132.4 Å²	132.4	76%	0.764	84%	0.841	S	S	*	*			trans	74.5	99.7	156	-63.7	0	0	0	0	115.9
1336	S	23.4	Very low	26.7	Very low	97 Å²	97	128.9 Å²	128.9	68%	0.678	84%	0.838	S	S	*	*				87.6	118.7	78.2	67.7	0	0	0	0	112.2
1337	E	23.5	Very low	26.5	Very low	189 Å²	189	125.6 Å²	125.6	88%	0.883	84%	0.837	S	S	*	*			trans	48	111.4	143.3	-62.8	-177.2	160.7	0	0	118.3
1338	A	27.4	Very low	26.4	Very low	104 Å²	104	125.3 Å²	125.3	86%	0.86	84%	0.836	S	S	*	*				166.9	135.6	106.7	0	0	0	0	0	111.4
1339	G	25.1	Very low	26.4	Very low	69 Å²	69	122.7 Å²	122.7	71%	0.711	84%	0.836	S	S	*	*			trans	107.6	93.7	133.7	0	0	0	0	0	118.6
1340	S	28.2	Very low	26.3	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	83%	0.832	S	S	*	*			trans	62.3	103.2	130.9	60.7	0	0	0	0	121.2
1341	D	23.5	Very low	26.2	Very low	160 Å²	160	123.6 Å²	123.6	86%	0.856	84%	0.836	S	S	*	*				36.2	151.9	116	-97.1	-3.7	0	0	0	122.5
1342	P	41	Very low	26.4	Very low	189 Å²	189	121.4 Å²	121.4	100%	1.227	83%	0.829	S	S	*	*			cis	-116.2	0	-8.8	38.3	-25	0	0	0	114.9

Retrieved 1,342 of 1,342 residues in 1099.3 ms (Link to these results)

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